A0A096M1G9_POEFO Loading...

Zinc finger protein 420-like

AlphaFold DB , UniProt , Accession A0A096M1G9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,274 aa.

						>A0A096M1G9_POEFO|A0A096M1G9
MAAADPKSPNRQKTPAEEVDTSGEQAAGAKSGCSPNQTDEAAGEKNGVCPNGELGAEDVGSNGGGSVASHSGEVGLESVAGAADKTTCVSPEDRAATEKMAEALDSQQQAFDWSDTEDDEEGAKSQTKENDKSDLKVAETVNNVKQDAPAEAESEKTDDGESSPEKLAVEDLRGEVDATEDRADDDEEADSTAKQRRCRWECKECGQKFSQREMFNLHRHFHAHEDELLPPTCKECGLTFQHRSSLIKHRNQHKEKEETLETTKLEDEMRAPFRYQCAECKRIFSQVSKLRDHDCNNAAEKPYHCTLCRQDFQFKVSVTKHMMMHSRECTFKCQECSQTFPNIMSLRFHQKSHAALKPYECPECGMAFKHYSVMEDHRRKHVDNSRSHLCNICGKTFKYSSLLHQHQYLHTGQKPFHCPECGKKFAFAQNMKAHCRQHRLRDTNSSVEPPGKQPLTSGHEAAKGPEKENTHTTEDTKRTFGCPLCPQTFYVAANLRAHMQFHEDEYEKQERLLQYQVVPNKHWEKGHTCPHCPSVFRDEPGLKGHLLSVHKPTAQYLETLAAPKKQLTQISSDNTQGKVLNIKSYKCSECGKSFRHRSVLELHMRIHSKDKPYQCKVCGKGFRFSSYLQQHLIIHTGKKPYKCPDCGKDFAFLQNMRTHQKLHQQKPFRCTSCRKGYSSETQLQQHMLSHNGDKPHKCELCDKSFGLAYLLRDHMNTHTGERPHRCEECHKSFSWFSSLLVHQKIHARKKQGLSHYNSYPSGTRMRGRGKRGGRPAWGWSRPSGVSEIVASPQNLYPVSPHRDADLHRQVRQQPLRTRVDSQTRHLTEAWPSEPHSQTLQWSVDSREAPAPSQPPQYDTPTQPHHQRSPGWADMPLMSLGSAPNLDSHMKDSTSSVLGSHVPKKTSPSAVSEMTQQRQHKLSSWNSTPTSTAMASTSSLQHDFPVPPSYMDGAALWSVRPTPLTNSQSSPNKLSQDLQLPRWPGGAEPSTPPKKEERLWDISGPPVMSSTVTQPEKTWNGCEPQKPWASGLAVAPASAQIDQSSSMPISAPTSHGVANNLWDIQTPPGAPKTVNSVEKLVNNQEFQKQVSPSWSSVQTPTQKVPISIQYEPHRFSQGIGTPVWAFQNNSVGPQTLLPGQLKPGGGQELQQQQPMATAAQIIINQPSPFFSPPLAPLPPLALPGPHPLHSVAVGAMPRPPHPNIFFTPQPVMTERPHMPQTLPLPQLPPQTEAHKLGSRLPFPPERLLQCMICGLSLPRELDLQMHYLQHAQGEI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.8	Very low	34.8	Very low	242 Å²	242	142.5 Å²	142.5	100%	1.192	83%	0.825	S	S	*	*				0	107.4	0	-64.6	164.7	-179.3	0	0	105.6
2	A	30	Very low	34.2	Very low	102 Å²	102	142.8 Å²	142.8	84%	0.843	81%	0.813	S	S	*	*				75.9	140	80.6	0	0	0	0	0	111.5
3	A	31.9	Very low	33.9	Very low	98 Å²	98	145.2 Å²	145.2	81%	0.81	81%	0.809	S	S	*	*			cis	-167.5	164.1	-2.2	0	0	0	0	0	108.3
4	A	32.1	Very low	33.7	Very low	97 Å²	97	143.2 Å²	143.2	80%	0.802	80%	0.803	S	S	*	*			cis	-165.4	-171.8	-15.3	0	0	0	0	0	109.7
5	D	40.2	Very low	34.5	Very low	142 Å²	142	141.7 Å²	141.7	76%	0.759	80%	0.801	S	S	*	*			trans	-61.3	156	171.3	-144.1	-76.2	0	0	0	112.5	K7	D5-K7 PolarHBondContact OD1-N 2.92Å
6	P	47.7	Very low	34.3	Very low	115 Å²	115	137.8 Å²	137.8	75%	0.747	79%	0.793	S	S	*	*				-153.8	130.3	101.3	36.4	-16.7	0	0	0	118.8
7	K	32.7	Very low	34.1	Very low	186 Å²	186	140 Å²	140	81%	0.809	79%	0.794	S	S	*	*				38.4	129	126.5	-64.4	179.6	178.3	175.2	0	123.8	D5	D5-K7 PolarHBondContact OD1-N 2.92Å
8	S	30.6	Very low	33.9	Very low	116 Å²	116	142.6 Å²	142.6	81%	0.811	80%	0.798	S	S	*	*			trans	-1.8	154.4	130	-96.5	0	0	0	0	121.1
9	P	47.2	Very low	33.7	Very low	114 Å²	114	143.2 Å²	143.2	74%	0.74	81%	0.805	S	S	*	*				-161.7	178.3	75.2	44.3	-23.3	0	0	0	121.5
10	N	28.4	Very low	33.4	Very low	143 Å²	143	143 Å²	143	77%	0.765	80%	0.802	S	S	*	*			trans	38.5	130.2	149.8	-78.6	-30.3	0	0	0	123.1
11	R	31.4	Very low	33.5	Very low	212 Å²	212	141.6 Å²	141.6	80%	0.8	80%	0.797	S	S	*	*				78.2	134.1	50.7	-158.9	-169.8	-173.6	-168.3	3.2	115.6
12	Q	27.5	Very low	33.6	Very low	146 Å²	146	135.5 Å²	135.5	68%	0.682	78%	0.779	S	S	*	*			trans	82.8	154.4	173	-49.8	-162.2	51.4	0	0	116
13	K	29.6	Very low	33.7	Very low	174 Å²	174	133.9 Å²	133.9	76%	0.757	77%	0.772	S	S	*	*			cis	-160.6	170.8	-18.9	-115.8	-174.8	-178.7	-179.1	0	110.6
14	T	31.3	Very low	33.9	Very low	118 Å²	118	137.1 Å²	137.1	72%	0.724	77%	0.77	S	S	*	*			trans	-33.2	163.6	161.3	50.4	0	0	0	0	117.6
15	P	46.5	Very low	34.1	Very low	120 Å²	120	140.3 Å²	140.3	78%	0.779	77%	0.769	S	S	*	*			cis	-155	-169.3	37.8	45.7	-24	0	0	0	119.8
16	A	30.8	Very low	33.7	Very low	80 Å²	80	137.3 Å²	137.3	66%	0.661	76%	0.763	S	S	*	*			trans	82.6	133	140.5	0	0	0	0	0	124.1
17	E	30.8	Very low	33.1	Very low	175 Å²	175	136.7 Å²	136.7	82%	0.818	77%	0.768	S	S	*	*			trans	48.4	122.6	137.4	-67.4	163.8	173	0	0	120.2
18	E	30.3	Very low	32.8	Very low	186 Å²	186	131 Å²	131	87%	0.869	76%	0.763	S	S	*	*				74.8	106.2	65	-73.6	-164.8	-177.8	0	0	115
19	V	30	Very low	32.9	Very low	154 Å²	154	130.3 Å²	130.3	93%	0.933	76%	0.764	S	S	*	*			trans	-142.5	144.9	152.4	178	0	0	0	0	107.4
20	D	29.2	Very low	32.2	Very low	139 Å²	139	134.4 Å²	134.4	74%	0.743	77%	0.77	S	S	*	*			trans	-139.9	178.9	-162	-175.3	21.9	0	0	0	111.5
21	T	33.8	Very low	32.2	Very low	114 Å²	114	133.2 Å²	133.2	70%	0.699	77%	0.773	S	S	*	*			trans	72.8	158.1	165.9	80.4	0	0	0	0	116.7
22	S	33.5	Very low	32	Very low	115 Å²	115	126.5 Å²	126.5	80%	0.804	77%	0.769	S	S	*	*			cis	-150.7	168.7	-6.6	22.2	0	0	0	0	108.3
23	G	31.7	Very low	32	Very low	68 Å²	68	126.3 Å²	126.3	70%	0.701	78%	0.783	S	S	*	*			cis	-140	-102.2	3.2	0	0	0	0	0	109.5
24	E	36.2	Very low	31.9	Very low	166 Å²	166	123.4 Å²	123.4	78%	0.776	79%	0.785	S	S	*	*				176.8	156.8	-59.4	-92.9	-164.1	116	0	0	106.5
25	Q	35.7	Very low	32.7	Very low	163 Å²	163	123.1 Å²	123.1	76%	0.762	79%	0.785	S	S	*	*			cis	-150.8	-177.8	-3.1	-120.2	-172.1	50.4	0	0	105.3
26	A	33.2	Very low	31.7	Very low	79 Å²	79	124.1 Å²	124.1	65%	0.653	78%	0.783	S	S	*	*			cis	-171.2	173.4	-7.3	0	0	0	0	0	105.4
27	A	34.1	Very low	31.7	Very low	103 Å²	103	128.3 Å²	128.3	85%	0.851	79%	0.789	S	S	*	*			cis	-167.6	161.8	-32.6	0	0	0	0	0	105.4
28	G	26.4	Very low	31.5	Very low	67 Å²	67	125.2 Å²	125.2	69%	0.691	78%	0.783	S	S	*	*			cis	-142.4	177.8	1.8	0	0	0	0	0	110.8
29	A	34.3	Very low	31.3	Very low	100 Å²	100	123 Å²	123	83%	0.826	78%	0.777	S	S	*	*			cis	81.3	139	47.3	0	0	0	0	0	112.9
30	K	32.1	Very low	31.3	Very low	200 Å²	200	124.6 Å²	124.6	87%	0.87	77%	0.774	S	S	*	*			cis	-126.5	-151.2	2.2	-51.6	170.3	-175.8	175.4	0	108.2
31	S	27.8	Very low	31.5	Very low	118 Å²	118	121.7 Å²	121.7	83%	0.825	77%	0.769	S	S	*	*			cis	-172.3	163	-10.1	28.3	0	0	0	0	106.8
32	G	27.9	Very low	31.6	Very low	71 Å²	71	121.6 Å²	121.6	73%	0.732	78%	0.78	S	S	*	*			cis	156	116.5	-7.7	0	0	0	0	0	113.6
33	C	26	Very low	31.3	Very low	142 Å²	142	119.2 Å²	119.2	96%	0.959	77%	0.774	S	S	*	*			trans	69	153	169.3	-80.1	0	0	0	0	121.8
34	S	28.1	Very low	31.4	Very low	114 Å²	114	123.4 Å²	123.4	80%	0.797	78%	0.775	S	S	*	*			trans	-83.2	171	173.7	-27.7	0	0	0	0	112.1
35	P	47.8	Very low	31.4	Very low	112 Å²	112	122.4 Å²	122.4	73%	0.727	77%	0.768	S	S	*	*				-155.8	-174.3	63.8	42.7	-20.7	0	0	0	118.4
36	N	27.3	Very low	31.1	Very low	140 Å²	140	121.9 Å²	121.9	75%	0.749	77%	0.77	S	S	*	*			trans	53.9	117.6	151.8	-73.8	0.8	0	0	0	125
37	Q	30.5	Very low	31	Very low	168 Å²	168	121.6 Å²	121.6	79%	0.785	78%	0.776	S	S	*	*				52.7	155.6	123.8	-64.2	-165.9	11.2	0	0	125.3
38	T	25.8	Very low	30.7	Very low	111 Å²	111	123.1 Å²	123.1	68%	0.681	77%	0.774	S	S	*	*			trans	82.5	115	153.8	38.1	0	0	0	0	122.6
39	D	26.8	Very low	30.8	Very low	140 Å²	140	125.4 Å²	125.4	75%	0.749	78%	0.778	S	S	*	*				87.8	124.7	127.1	-57.5	-12.6	0	0	0	125.7
40	E	29.9	Very low	31.6	Very low	187 Å²	187	126.3 Å²	126.3	87%	0.874	78%	0.776	S	S	*	*			trans	57.2	150.8	134.9	-62.7	-126.1	110.2	0	0	122.8
41	A	33.5	Very low	31.4	Very low	77 Å²	77	124.4 Å²	124.4	64%	0.636	78%	0.775	S	S	*	*			cis	-170.9	176.2	-19.3	0	0	0	0	0	112.3
42	A	34.4	Very low	31.4	Very low	112 Å²	112	121.8 Å²	121.8	93%	0.926	77%	0.767	S	S	*	*			trans	78.7	152.5	155.9	0	0	0	0	0	122
43	G	28.5	Very low	31.4	Very low	66 Å²	66	126.6 Å²	126.6	68%	0.68	77%	0.77	S	S	*	*			trans	116.6	68.9	176.2	0	0	0	0	0	115.1
44	E	33.6	Very low	31.5	Very low	156 Å²	156	127.6 Å²	127.6	73%	0.729	77%	0.765	S	S	*	*				68.6	138.7	95	-65.8	-152.8	138	0	0	116.1
45	K	35.3	Very low	31.4	Very low	145 Å²	145	125.6 Å²	125.6	63%	0.63	76%	0.763	S	S	*	*			cis	-160.8	145.6	8.2	-122.8	163.5	-179.1	140.5	0	112.3
46	N	30.7	Very low	30.5	Very low	151 Å²	151	125.1 Å²	125.1	81%	0.807	77%	0.768	S	S	*	*			trans	53.6	139.8	150.9	-55.3	-11.4	0	0	0	121
47	G	30.8	Very low	30.5	Very low	74 Å²	74	127.3 Å²	127.3	76%	0.763	77%	0.774	S	S	*	*			cis	-172.2	-140.3	1.5	0	0	0	0	0	109.1
48	V	26.6	Very low	30.5	Very low	134 Å²	134	126.9 Å²	126.9	81%	0.812	78%	0.777	S	S	*	*			cis	-156.9	155.2	-6.8	-175.6	0	0	0	0	107.2
49	C	28.7	Very low	30.7	Very low	116 Å²	116	128 Å²	128	78%	0.784	78%	0.783	S	S	*	*			trans	-133.2	166.6	168.5	-58.3	0	0	0	0	109.7
50	P	52.2	Low	30.7	Very low	119 Å²	119	124.9 Å²	124.9	77%	0.773	78%	0.784	S	S	*	*				-159.6	178.8	93	42.7	-22.6	0	0	0	118.8
51	N	28.2	Very low	31.1	Very low	159 Å²	159	121.6 Å²	121.6	85%	0.85	78%	0.782	S	S	*	*			trans	-24.3	176.2	148	-36.6	-21.8	0	0	0	117.5
52	G	26	Very low	30.9	Very low	64 Å²	64	126.3 Å²	126.3	66%	0.66	80%	0.796	S	S	*	*			cis	179.6	156.6	7.1	0	0	0	0	0	109.9
53	E	28.5	Very low	30.6	Very low	172 Å²	172	124.3 Å²	124.3	80%	0.804	79%	0.787	S	S	*	*				94.9	144.1	96.2	-152.2	-173.4	157.3	0	0	114.3
54	L	28.7	Very low	30.5	Very low	163 Å²	163	125.3 Å²	125.3	85%	0.853	80%	0.797	S	S	*	*			trans	65.2	157.5	175.6	-44.4	179	0	0	0	116.9
55	G	25.4	Very low	30.2	Very low	72 Å²	72	121.3 Å²	121.3	74%	0.742	80%	0.798	S	S	*	*			cis	170.4	140.4	-14.8	0	0	0	0	0	114.8
56	A	29.8	Very low	30	Very low	101 Å²	101	120 Å²	120	84%	0.835	81%	0.807	S	S	*	*			trans	68.3	162.1	152.1	0	0	0	0	0	124.3
57	E	27.4	Very low	30	Very low	187 Å²	187	119.6 Å²	119.6	87%	0.874	81%	0.81	S	S	*	*			trans	74.2	102.4	155.7	-44	-151.9	144.4	0	0	124.2
58	D	28.7	Very low	29.7	Very low	158 Å²	158	120.5 Å²	120.5	85%	0.845	81%	0.81	S	S	*	*				54	154.8	120.1	-128	-22.2	0	0	0	126.6
59	V	31.6	Very low	30.1	Very low	135 Å²	135	118.8 Å²	118.8	82%	0.818	80%	0.804	S	S	*	*			trans	50.5	124.5	163.8	-167.2	0	0	0	0	121.4
60	G	27	Very low	30.1	Very low	75 Å²	75	121.1 Å²	121.1	77%	0.773	80%	0.803	S	S	*	*			trans	151.2	121.8	145.3	0	0	0	0	0	117.5
61	S	37.3	Very low	29.2	Very low	117 Å²	117	120.2 Å²	120.2	82%	0.818	80%	0.799	S	S	*	*			trans	-111.6	139.6	-179.8	-61	0	0	0	0	113.8
62	N	28.7	Very low	29.1	Very low	176 Å²	176	115.6 Å²	115.6	94%	0.941	79%	0.789	S	S	*	*			trans	176.1	151	147.2	-92.6	-32.6	0	0	0	110.2
63	G	29.6	Very low	29.5	Very low	71 Å²	71	119.9 Å²	119.9	73%	0.732	79%	0.792	S	S	*	*			cis	169.9	145.9	-9	0	0	0	0	0	113
64	G	25.6	Very low	29.6	Very low	87 Å²	87	118.6 Å²	118.6	90%	0.897	80%	0.796	S	S	*	*			trans	89.7	137.4	169.2	0	0	0	0	0	117.3
65	G	26.9	Very low	29.5	Very low	72 Å²	72	114.2 Å²	114.2	74%	0.742	79%	0.79	S	S	*	*			cis	168.5	154	-12.1	0	0	0	0	0	114.4
66	S	31.4	Very low	29.7	Very low	118 Å²	118	118.4 Å²	118.4	83%	0.825	79%	0.794	S	S	*	*			trans	51.9	143.2	148.8	-61	0	0	0	0	121.1
67	V	30.3	Very low	29.6	Very low	142 Å²	142	121.4 Å²	121.4	86%	0.861	79%	0.791	S	S	*	*			cis	-158.6	174.3	-0.4	-100.2	0	0	0	0	107.1
68	A	26.2	Very low	29.9	Very low	93 Å²	93	117.2 Å²	117.2	77%	0.769	78%	0.783	S	S	*	*			cis	-157.3	177.5	30.6	0	0	0	0	0	114.8
69	S	34.1	Very low	29.8	Very low	98 Å²	98	116.5 Å²	116.5	69%	0.685	78%	0.783	S	S	*	*			trans	-77.7	-172.1	-177.5	-39.3	0	0	0	0	115
70	H	29.6	Very low	29.7	Very low	165 Å²	165	114.8 Å²	114.8	76%	0.764	78%	0.783	S	S	*	*			cis	-152.6	148.5	16.4	-98.3	-59.5	0	0	0	109.2
71	S	32.3	Very low	29.7	Very low	100 Å²	100	114.8 Å²	114.8	70%	0.699	78%	0.784	S	S	*	*				82.7	131.5	71.2	-51.3	0	0	0	0	117
72	G	26.5	Very low	29.2	Very low	61 Å²	61	114.5 Å²	114.5	63%	0.629	79%	0.789	S	S	*	*			trans	134.2	114	178.4	0	0	0	0	0	113
73	E	33.4	Very low	29.5	Very low	154 Å²	154	110.9 Å²	110.9	72%	0.72	78%	0.783	S	S	*	*			cis	82.6	131.7	16.9	-61.3	92.7	76.6	0	0	116.9
74	V	30.5	Very low	29.5	Very low	146 Å²	146	115.1 Å²	115.1	89%	0.885	79%	0.789	S	S	*	*			cis	-164.6	160.1	-13.9	-88.7	0	0	0	0	112.5
75	G	27	Very low	30.1	Very low	71 Å²	71	119.8 Å²	119.8	73%	0.732	78%	0.784	S	S	*	*			trans	117.9	159.8	156.2	0	0	0	0	0	118.8
76	L	30	Very low	30.1	Very low	160 Å²	160	122 Å²	122	84%	0.838	78%	0.783	S	S	*	*			cis	-164.1	152.9	-11.9	-99.1	173.4	0	0	0	112.1
77	E	27.4	Very low	29.9	Very low	163 Å²	163	122.2 Å²	122.2	76%	0.762	78%	0.78	S	S	*	*			trans	57.9	125.9	154.4	-63.3	-166	109.3	0	0	122.7
78	S	33.7	Very low	29.8	Very low	100 Å²	100	121 Å²	121	70%	0.699	78%	0.776	S	S	*	*				95.8	144.1	74.4	-57.1	0	0	0	0	112.3
79	V	26.7	Very low	29.8	Very low	142 Å²	142	123 Å²	123	86%	0.861	78%	0.779	S	S	*	*			cis	-155.6	171.7	44	168.6	0	0	0	0	111.8
80	A	29.4	Very low	29.7	Very low	99 Å²	99	123 Å²	123	82%	0.818	78%	0.779	S	S	*	*			trans	-56.9	173.6	175.5	0	0	0	0	0	116.7
81	G	27.4	Very low	30.5	Very low	76 Å²	76	120.5 Å²	120.5	78%	0.784	78%	0.777	S	S	*	*			cis	-143.6	-134.8	9.4	0	0	0	0	0	113
82	A	27	Very low	30.6	Very low	111 Å²	111	123.7 Å²	123.7	92%	0.917	78%	0.781	S	S	*	*			cis	-156.9	-159	3.1	0	0	0	0	0	110.8
83	A	35.3	Very low	30.9	Very low	99 Å²	99	126.5 Å²	126.5	82%	0.818	78%	0.782	S	S	*	*			trans	-151.5	160.2	-172.6	0	0	0	0	0	114.7
84	D	29	Very low	30.9	Very low	160 Å²	160	129.2 Å²	129.2	86%	0.856	79%	0.785	S	S	*	*			trans	-164.5	174.1	140.8	-136.5	-33.4	0	0	0	114.4
85	K	38.6	Very low	30.9	Very low	186 Å²	186	126.9 Å²	126.9	81%	0.809	78%	0.781	S	S	*	*			trans	-120.7	174.8	-176.9	-62.4	174.7	-178.3	173	0	111.8
86	T	26.5	Very low	31.1	Very low	118 Å²	118	127.9 Å²	127.9	72%	0.724	78%	0.782	S	S	*	*				169.4	133.5	86.9	-71.2	0	0	0	0	113.5
87	T	27.3	Very low	31	Very low	122 Å²	122	126 Å²	126	75%	0.748	78%	0.778	S	S	*	*			trans	52.6	120.1	148.9	-51.4	0	0	0	0	126.3
88	C	27.7	Very low	31.1	Very low	116 Å²	116	125.7 Å²	125.7	78%	0.784	78%	0.776	S	S	*	*			trans	8	156.1	140.1	-44.9	0	0	0	0	125.7
89	V	25.9	Very low	30.9	Very low	137 Å²	137	127.7 Å²	127.7	83%	0.83	77%	0.772	S	S	*	*				-176.3	151.3	119.2	144.6	0	0	0	0	112.3
90	S	31.8	Very low	30.9	Very low	98 Å²	98	129 Å²	129	69%	0.685	77%	0.771	S	S	*	*			trans	-140.5	148.9	169	-58.3	0	0	0	0	111.3	E92	S90-E92 WeakPolarHBondContact CB-OE2 3.42Å
91	P	46.7	Very low	30.9	Very low	112 Å²	112	128.1 Å²	128.1	73%	0.727	76%	0.764	S	S	*	*				-145.3	175.9	110.4	42.8	-28.2	0	0	0	113.4
92	E	35.2	Very low	30.9	Very low	167 Å²	167	133.5 Å²	133.5	78%	0.78	77%	0.769	S	S	*	*			cis	86.1	137.9	16.6	-64	144.2	83	0	0	114.8	S90	S90-E92 WeakPolarHBondContact CB-OE2 3.42Å
93	D	33.3	Very low	31.1	Very low	119 Å²	119	131.9 Å²	131.9	64%	0.636	76%	0.755	S	S	*	*			cis	-162.5	171	-2.2	176.7	35.3	0	0	0	112
94	R	32	Very low	30.6	Very low	212 Å²	212	134.5 Å²	134.5	80%	0.8	76%	0.755	S	S	*	*			trans	73.1	116.2	154	-95.7	166.7	173.3	104.2	-9.7	125.4
95	A	30.5	Very low	30.6	Very low	96 Å²	96	133.4 Å²	133.4	79%	0.793	75%	0.749	S	S	*	*				59.9	148.4	121	0	0	0	0	0	126.1
96	A	31.8	Very low	30.1	Very low	92 Å²	92	128.6 Å²	128.6	76%	0.76	74%	0.739	S	S	*	*			trans	78.5	160	152.4	0	0	0	0	0	121
97	T	28.5	Very low	30.3	Very low	122 Å²	122	130.9 Å²	130.9	75%	0.748	74%	0.741	S	S	*	*			cis	-168.7	145.6	-40.5	39.4	0	0	0	0	111.4
98	E	27.8	Very low	30.4	Very low	155 Å²	155	131.9 Å²	131.9	72%	0.724	74%	0.737	S	S	*	*			trans	60.6	167.7	165.8	-64.3	-162.1	126.8	0	0	116.9
99	K	29.5	Very low	30.4	Very low	142 Å²	142	134.1 Å²	134.1	62%	0.617	74%	0.737	S	S	*	*			cis	-163.7	151.2	-26	-112.1	174.2	176	152.4	0	109.1
100	M	26.9	Very low	30.5	Very low	169 Å²	169	130.9 Å²	130.9	83%	0.833	72%	0.724	S	S	*	*			trans	63.9	157.6	146.8	-71.6	166.2	176.5	0	0	119.6
101	A	30.5	Very low	30.3	Very low	81 Å²	81	135.1 Å²	135.1	67%	0.669	73%	0.73	S	S	*	*			cis	-165.2	-174.5	-17.2	0	0	0	0	0	111.4
102	E	27.2	Very low	29.3	Very low	190 Å²	190	134.7 Å²	134.7	89%	0.888	72%	0.722	S	S	*	*			trans	74.5	145.9	161.6	-64.2	-168.8	121.8	0	0	119.1
103	A	30.2	Very low	28.7	Very low	76 Å²	76	136.8 Å²	136.8	63%	0.628	72%	0.723	S	S	*	*			cis	-169.6	171.6	-15	0	0	0	0	0	108.8
104	L	26.5	Very low	28.4	Very low	155 Å²	155	134.8 Å²	134.8	81%	0.812	72%	0.718	S	S	*	*			cis	-103.4	-109.2	-6.3	-73	163.6	0	0	0	109.5
105	D	27.2	Very low	28.1	Very low	136 Å²	136	130.9 Å²	130.9	73%	0.727	71%	0.713	S	S	*	*			cis	-170.9	155.2	-10.4	-138.7	13.1	0	0	0	107.5
106	S	28.8	Very low	28	Very low	86 Å²	86	132.8 Å²	132.8	60%	0.601	72%	0.715	S	S	*	*			cis	-164.9	160.2	-12.5	-133.5	0	0	0	0	109.6
107	Q	30.5	Very low	28	Very low	165 Å²	165	136.5 Å²	136.5	77%	0.771	72%	0.716	S	S	*	*			trans	61.5	147.5	171.1	-69.4	178.8	-10.8	0	0	117.1
108	Q	30.2	Very low	28	Very low	143 Å²	143	137.9 Å²	137.9	67%	0.668	72%	0.719	S	S	*	*			cis	-159.8	163.8	-23.8	-134.5	173.7	-53.6	0	0	110.1
109	Q	28.1	Very low	28.1	Very low	164 Å²	164	137.1 Å²	137.1	77%	0.766	72%	0.72	S	S	*	*			trans	-6	151.1	151.4	-72.6	171.5	-73.8	0	0	119.9
110	A	26.9	Very low	28.2	Very low	68 Å²	68	137.6 Å²	137.6	56%	0.562	73%	0.725	S	S	*	*			cis	178.7	167.8	-1.2	0	0	0	0	0	111.5
111	F	27.2	Very low	28.4	Very low	187 Å²	187	136.5 Å²	136.5	82%	0.82	72%	0.718	S	S	*	*			trans	59.8	155.7	137.7	-81.9	-134.5	0	0	0	118.9
112	D	25.6	Very low	28.4	Very low	103 Å²	103	135.4 Å²	135.4	55%	0.551	71%	0.714	S	S	*	*			cis	-155.6	171.9	-11.3	-128.8	-160.8	0	0	0	111.1
113	W	24.6	Very low	28.6	Very low	212 Å²	212	129.9 Å²	129.9	80%	0.803	70%	0.701	S	S	*	*			trans	5.2	164.6	137.2	-68.2	59.4	0	0	0	120.9
114	S	25.5	Very low	28.5	Very low	76 Å²	76	134.2 Å²	134.2	53%	0.531	71%	0.706	S	S	.	*			cis	179.5	165.7	-21.9	-87.6	0	0	0	0	108.3
115	D	26.2	Very low	28.5	Very low	130 Å²	130	131.4 Å²	131.4	70%	0.695	70%	0.699	S	S	*	*			trans	56.6	160.5	142.5	-66.6	-35.4	0	0	0	123.7
116	T	27.5	Very low	28.6	Very low	136 Å²	136	132.6 Å²	132.6	83%	0.834	70%	0.7	S	S	*	*			trans	78.7	161.4	154.8	35.1	0	0	0	0	120.5
117	E	33.3	Very low	28.4	Very low	170 Å²	170	134.5 Å²	134.5	79%	0.794	71%	0.708	S	S	*	*			trans	-104.7	-154.8	-162.7	-61.4	169.1	112.6	0	0	109.6
118	D	27.5	Very low	28.2	Very low	151 Å²	151	132.5 Å²	132.5	81%	0.807	70%	0.697	S	S	*	*			trans	69.7	145.8	165.9	-54.1	-12.5	0	0	0	116.6
119	D	30.4	Very low	28.1	Very low	140 Å²	140	133.5 Å²	133.5	75%	0.749	70%	0.702	S	S	*	*			cis	-160.8	177.8	-26.6	-146.1	-15.2	0	0	0	109.9
120	E	30.7	Very low	28	Very low	152 Å²	152	130.9 Å²	130.9	71%	0.71	69%	0.693	S	S	*	*			trans	57.7	149.7	145.6	-80.5	-77.6	72.5	0	0	124.8
121	E	31.5	Very low	27.9	Very low	146 Å²	146	134.2 Å²	134.2	68%	0.682	70%	0.701	S	S	*	*			trans	14.4	157.1	157.2	-72.3	-133	140	0	0	123.6
122	G	31.1	Very low	27.8	Very low	58 Å²	58	133.6 Å²	133.6	60%	0.598	70%	0.699	S	S	*	*			cis	-154.6	156.9	11.5	0	0	0	0	0	112.7
123	A	31.6	Very low	27.9	Very low	74 Å²	74	133.2 Å²	133.2	61%	0.612	70%	0.704	S	S	*	*				82.1	135.7	82.8	0	0	0	0	0	112.2
124	K	27.7	Very low	27.9	Very low	166 Å²	166	129 Å²	129	72%	0.722	70%	0.697	S	S	*	*			cis	-159.4	137.4	12.2	-131.2	160.4	-167.5	125.8	0	110.8
125	S	26.6	Very low	28.1	Very low	97 Å²	97	132.4 Å²	132.4	68%	0.678	71%	0.709	S	S	*	*			trans	55.9	162.9	139.9	63.8	0	0	0	0	119.9
126	Q	28.2	Very low	28	Very low	161 Å²	161	134.6 Å²	134.6	75%	0.752	71%	0.712	S	S	*	*			cis	-159.9	152.4	22.1	-151.8	159.4	-6.8	0	0	113.6
127	T	25	Very low	27.9	Very low	125 Å²	125	134.6 Å²	134.6	77%	0.767	71%	0.711	S	S	*	*			trans	66.1	133.9	149.6	33.2	0	0	0	0	123.3
128	K	27.3	Very low	27.6	Very low	123 Å²	123	129.9 Å²	129.9	54%	0.535	70%	0.701	S	S	.	*			trans	-65.3	178.7	153.9	-54.7	-177.5	172.4	-173.8	0	109.3
129	E	27.4	Very low	27.6	Very low	165 Å²	165	131.3 Å²	131.3	77%	0.771	70%	0.703	S	S	*	*				-159.7	-159.7	54.5	-74.5	-166.8	128.6	0	0	112.5
130	N	25.3	Very low	27.4	Very low	109 Å²	109	131 Å²	131	58%	0.583	71%	0.706	S	S	*	*			trans	-73.2	-174.2	-179.7	-52.7	-36.1	0	0	0	111.1	S836	N130-S836 PolarHBondContact OD1-OG 3.02Å
131	D	24.7	Very low	27.2	Very low	137 Å²	137	129.2 Å²	129.2	73%	0.733	71%	0.706	S	S	*	*			cis	-160.1	-163.5	24.2	-143.8	-57.2	0	0	0	112.6
132	K	27.1	Very low	26.8	Very low	175 Å²	175	128.6 Å²	128.6	76%	0.761	71%	0.707	S	S	*	*			trans	-57.4	163.5	163.9	-64.6	166.8	175.6	166.2	0	110.9
133	S	25.8	Very low	26.7	Very low	94 Å²	94	132.6 Å²	132.6	66%	0.657	72%	0.715	S	S	*	*			cis	-152.1	-161.4	22.2	40.2	0	0	0	0	112.6
134	D	25.9	Very low	26.6	Very low	123 Å²	123	134.9 Å²	134.9	66%	0.658	72%	0.721	S	S	*	*			trans	83.3	120.2	158.9	-58.5	-60.8	0	0	0	117.5
135	L	28.5	Very low	27	Very low	149 Å²	149	134.9 Å²	134.9	78%	0.78	72%	0.721	S	S	*	*				62.3	139.2	84.5	-62.9	176.1	0	0	0	113.8
136	K	25.7	Very low	27.2	Very low	175 Å²	175	136.8 Å²	136.8	76%	0.761	72%	0.719	S	S	*	*			cis	-178.6	146.5	-21.4	-156.1	-164.2	-179	-177.3	0	106.2
137	V	25.3	Very low	27.4	Very low	136 Å²	136	135.3 Å²	135.3	82%	0.824	72%	0.716	S	S	*	*			trans	68.9	147.2	166.8	167.6	0	0	0	0	114
138	A	26.7	Very low	27.5	Very low	71 Å²	71	134 Å²	134	59%	0.587	72%	0.718	S	S	*	*			cis	-131.5	158.3	14.2	0	0	0	0	0	115.2
139	E	27	Very low	27.9	Very low	182 Å²	182	134.7 Å²	134.7	85%	0.85	74%	0.735	S	S	*	*			trans	48.7	116	139.4	-70.1	173.7	176.4	0	0	119.2
140	T	25.8	Very low	28.1	Very low	132 Å²	132	130.9 Å²	130.9	81%	0.81	73%	0.732	S	S	*	*			cis	-146.5	178.6	11.8	62.9	0	0	0	0	109.8
141	V	26.1	Very low	27.9	Very low	116 Å²	116	134.2 Å²	134.2	70%	0.703	74%	0.744	S	S	*	*			cis	-149.1	177.6	10.6	78.8	0	0	0	0	111.5	N143	V141-N143 PolarHBondContact O-N 3.28Å
142	N	24.9	Very low	28.1	Very low	132 Å²	132	131.6 Å²	131.6	71%	0.706	74%	0.741	S	S	*	*			trans	-47.9	123	178.4	-56.4	-26.9	0	0	0	113.7
143	N	28.3	Very low	28	Very low	143 Å²	143	131.9 Å²	131.9	77%	0.765	75%	0.745	S	S	*	*				83.9	144.1	58.9	-72.2	-24.7	0	0	0	113.3	V141	V141-N143 PolarHBondContact O-N 3.28Å
144	V	30.2	Very low	28.4	Very low	121 Å²	121	132.8 Å²	132.8	73%	0.733	75%	0.752	S	S	*	*			cis	-161.9	134.1	-5.5	120	0	0	0	0	106.5
145	K	34.1	Very low	28.6	Very low	166 Å²	166	134.2 Å²	134.2	72%	0.722	75%	0.754	S	S	*	*				80.3	102.7	73.8	-154.2	179.7	-169	-83.6	0	118.1
146	Q	31.4	Very low	28.6	Very low	138 Å²	138	134 Å²	134	65%	0.645	75%	0.747	S	S	*	*			trans	69.5	123.2	145.1	-68.8	-170.2	-82.3	0	0	125.9
147	D	32	Very low	28.6	Very low	130 Å²	130	131.7 Å²	131.7	70%	0.695	75%	0.748	S	S	*	*				60.4	85.3	127.3	-55.5	-44.9	0	0	0	124.1
148	A	27.9	Very low	28.5	Very low	97 Å²	97	130.5 Å²	130.5	80%	0.802	74%	0.737	S	S	*	*			trans	59.9	162.6	139.8	0	0	0	0	0	121.8
149	P	36.5	Very low	28.4	Very low	138 Å²	138	135.2 Å²	135.2	90%	0.896	75%	0.753	S	S	*	*			cis	-110.6	-130.8	-11.2	40.4	-26.1	0	0	0	112.3
150	A	31.2	Very low	28.3	Very low	85 Å²	85	129.6 Å²	129.6	70%	0.702	74%	0.743	S	S	*	*			trans	-114.4	178.2	-164.5	0	0	0	0	0	115.6
151	E	21.3	Very low	28.3	Very low	178 Å²	178	132.5 Å²	132.5	83%	0.832	75%	0.748	S	S	*	*			trans	102.9	106.1	172	-59.6	-60	142.1	0	0	118.7
152	A	27.9	Very low	28.2	Very low	82 Å²	82	132 Å²	132	68%	0.678	75%	0.749	S	S	*	*			trans	55.4	112.9	132	0	0	0	0	0	125
153	E	24.5	Very low	28.3	Very low	181 Å²	181	131.1 Å²	131.1	85%	0.846	75%	0.753	S	S	*	*				68.5	97	123.2	-61.2	-170.3	174	0	0	123.3
154	S	34.5	Very low	28.6	Very low	113 Å²	113	129.9 Å²	129.9	79%	0.79	75%	0.753	S	S	*	*				33.3	128.7	123.1	58.2	0	0	0	0	122.9
155	E	30.1	Very low	28.3	Very low	153 Å²	153	130.8 Å²	130.8	72%	0.715	75%	0.749	S	S	*	*			trans	-128.7	139	152.5	-77.7	-161.3	101.7	0	0	111
156	K	29	Very low	28.1	Very low	144 Å²	144	130 Å²	130	63%	0.626	75%	0.746	S	S	*	*			trans	54.3	151	137.3	-55.3	176.4	175.9	144.1	0	120.5	D158	K156-D158 WeakPolarHBondContact CG-OD1 3.38Å; K156-D158 WeakPolarHBondContact CG-OD2 3.47Å
157	T	25.6	Very low	28.3	Very low	128 Å²	128	130.2 Å²	130.2	79%	0.785	75%	0.751	S	S	*	*			cis	-105.6	135.8	3.7	48.1	0	0	0	0	110.9
158	D	23.4	Very low	28	Very low	111 Å²	111	127.9 Å²	127.9	59%	0.594	75%	0.75	S	S	*	*				66.4	120.3	57.6	-48.8	-1.2	0	0	0	110.9	K156	K156-D158 WeakPolarHBondContact CG-OD1 3.38Å; K156-D158 WeakPolarHBondContact CG-OD2 3.47Å
159	D	23.7	Very low	28.3	Very low	170 Å²	170	128 Å²	128	91%	0.909	74%	0.74	S	S	*	*			cis	-159	171.3	-9	-164.1	10.6	0	0	0	111.1
160	G	25.6	Very low	27.9	Very low	64 Å²	64	130.5 Å²	130.5	66%	0.66	74%	0.74	S	S	*	*			trans	-167.2	114	180	0	0	0	0	0	115.5	S162	G160-S162 PolarHBondContact O-N 3.35Å
161	E	26.3	Very low	27.6	Very low	192 Å²	192	132.2 Å²	132.2	90%	0.897	74%	0.737	S	S	*	*			trans	-52	123.8	-176	-67.2	172.5	102.4	0	0	114
162	S	24.8	Very low	28.1	Very low	105 Å²	105	130.9 Å²	130.9	73%	0.734	74%	0.735	S	S	*	*				105.7	137.9	71	89.8	0	0	0	0	112.1	G160	G160-S162 PolarHBondContact O-N 3.35Å
163	S	26.9	Very low	28.1	Very low	114 Å²	114	138.2 Å²	138.2	80%	0.797	75%	0.745	S	S	*	*			trans	-76.7	157.3	176	-36.3	0	0	0	0	110.6
164	P	33	Very low	28.3	Very low	117 Å²	117	133.1 Å²	133.1	76%	0.76	74%	0.741	S	S	*	*				-155	-168.5	72.2	37.7	-14.9	0	0	0	116.5
165	E	25.1	Very low	28	Very low	140 Å²	140	137 Å²	137	65%	0.654	75%	0.747	S	S	*	*			trans	79.4	145.3	157.9	-70	-153.7	113.7	0	0	122
166	K	30	Very low	27.9	Very low	151 Å²	151	136 Å²	136	66%	0.657	75%	0.751	S	S	*	*			trans	69	144.8	140.3	-79.2	163.7	-173.7	150.6	0	121.8
167	L	34.6	Very low	27.7	Very low	141 Å²	141	134.8 Å²	134.8	74%	0.738	75%	0.751	S	S	*	*			trans	53.5	121.5	141.5	-61.5	170.6	0	0	0	118.3	V169	L167-V169 HydrophobicContact CD2-CG2 4.09Å
168	A	26.9	Very low	27.6	Very low	81 Å²	81	132.6 Å²	132.6	67%	0.669	75%	0.746	S	S	*	*			cis	62.5	157.3	14.2	0	0	0	0	0	116.8
169	V	33.2	Very low	27.8	Very low	100 Å²	100	132 Å²	132	61%	0.606	75%	0.746	S	S	*	*			trans	82.6	127	-172.2	-170.2	0	0	0	0	112	L167	L167-V169 HydrophobicContact CD2-CG2 4.09Å
170	E	28.3	Very low	28	Very low	191 Å²	191	131.5 Å²	131.5	89%	0.893	74%	0.739	S	S	*	*	S	Bend	cis	-72.9	118.5	4.9	-62.6	175.3	144.3	0	0	111.3
171	D	26	Very low	28.1	Very low	120 Å²	120	133.4 Å²	133.4	64%	0.642	73%	0.734	S	S	*	*				77.4	127.4	75.4	-90.8	-13.5	0	0	0	112.5
172	L	31.5	Very low	28.4	Very low	150 Å²	150	132.5 Å²	132.5	79%	0.785	72%	0.722	S	S	*	*			cis	-140.1	175.4	15.5	-110.1	166.6	0	0	0	113.6
173	R	26.9	Very low	28.8	Very low	237 Å²	237	130.7 Å²	130.7	89%	0.894	71%	0.713	S	S	*	*			trans	-72.7	157.7	170.3	-62.7	157.9	165.2	-105	3.3	111.4
174	G	29.1	Very low	29.1	Very low	74 Å²	74	129.4 Å²	129.4	76%	0.763	70%	0.698	S	S	*	*			trans	-165.5	97	165	0	0	0	0	0	114.2
175	E	27.1	Very low	29	Very low	195 Å²	195	130.3 Å²	130.3	91%	0.911	70%	0.696	S	S	*	*			trans	-76	131.1	139.6	-77.5	174.9	101.1	0	0	106.9
176	V	29.1	Very low	29.3	Very low	130 Å²	130	130.5 Å²	130.5	79%	0.788	70%	0.702	S	S	*	*			trans	-166.9	170.4	136.8	-98.4	0	0	0	0	109.2
177	D	24.7	Very low	29.5	Very low	120 Å²	120	130.9 Å²	130.9	64%	0.642	71%	0.706	S	S	*	*			trans	-4.9	150.3	153.3	-60	-76.7	0	0	0	118.8
178	A	24.4	Very low	29.3	Very low	82 Å²	82	132.5 Å²	132.5	68%	0.678	71%	0.71	S	S	*	*			cis	57.6	169.7	49.8	0	0	0	0	0	112.4
179	T	26.8	Very low	29.4	Very low	97 Å²	97	132.9 Å²	132.9	60%	0.595	71%	0.713	S	S	*	*			trans	58.4	102.8	-171.3	60.1	0	0	0	0	113.3
180	E	27.2	Very low	29.1	Very low	160 Å²	160	135.5 Å²	135.5	75%	0.748	72%	0.723	S	S	*	*				91	140.9	98.5	-75.8	153.4	-159.8	0	0	111.3
181	D	29	Very low	29.3	Very low	105 Å²	105	130.5 Å²	130.5	56%	0.561	71%	0.709	S	S	*	*			cis	-148.1	171	0.5	-134.8	-8.1	0	0	0	115.7
182	R	31.9	Very low	29.5	Very low	173 Å²	173	131.5 Å²	131.5	65%	0.653	72%	0.72	S	S	*	*			trans	-0.5	149.1	142.6	-68	163.5	-173.7	101.9	7.8	117.6	D184	R182-D184 VanDerWaalsContact CB-OD2 3.28Å; R182-D184 WeakPolarHBondContact CB-OD2 3.34Å; R182-D184 WeakPolarHBondContact CD-OD2 3.3Å; R182-D184 WeakPolarHBondContact CG-OD2 3.18Å
183	A	33.6	Very low	29.8	Very low	66 Å²	66	128.3 Å²	128.3	55%	0.545	72%	0.715	S	S	.	*			cis	-113.1	147.9	35	0	0	0	0	0	113.6
184	D	31.8	Very low	30.5	Very low	88 Å²	88	127.6 Å²	127.6	47%	0.471	72%	0.719	S	S	.	*			cis	68.1	128.8	49.2	-49.2	-26.1	0	0	0	110.2	R182 N1058	R182-D184 VanDerWaalsContact CB-OD2 3.28Å; R182-D184 WeakPolarHBondContact CB-OD2 3.34Å; R182-D184 WeakPolarHBondContact CD-OD2 3.3Å; R182-D184 WeakPolarHBondContact CG-OD2 3.18Å; D184-N1058 PolarHBondContact O-ND2 3.18Å
185	D	31.2	Very low	31.1	Very low	135 Å²	135	132.2 Å²	132.2	72%	0.722	72%	0.72	S	S	*	*			cis	-145	172.4	10.1	-79.9	-54	0	0	0	112.5
186	D	31.6	Very low	31.9	Very low	145 Å²	145	132.3 Å²	132.3	78%	0.775	71%	0.713	S	S	*	*			trans	16.8	152.5	138	-64.9	-9.2	0	0	0	122
187	E	34.1	Very low	32.7	Very low	159 Å²	159	133.6 Å²	133.6	74%	0.743	70%	0.703	S	S	*	*			cis	-161.9	168.6	1.7	-117	-84.7	-136.7	0	0	111
188	E	31.5	Very low	33.7	Very low	175 Å²	175	132.3 Å²	132.3	82%	0.818	70%	0.703	S	S	*	*			trans	60.7	164.1	155.4	-117.2	-164.8	161.1	0	0	123.9
189	A	28	Very low	35.2	Very low	89 Å²	89	136.5 Å²	136.5	74%	0.736	70%	0.701	S	S	*	*			trans	77.8	82.9	159.1	0	0	0	0	0	122.3
190	D	27.2	Very low	36.6	Very low	154 Å²	154	135.9 Å²	135.9	82%	0.824	69%	0.688	S	S	*	*			trans	79.5	141.4	131.2	-159.3	27.6	0	0	0	122.9
191	S	33.3	Very low	38.5	Very low	86 Å²	86	133 Å²	133	60%	0.601	67%	0.674	S	S	*	*			trans	43.1	108.7	153.9	-75.2	0	0	0	0	121.5
192	T	30	Very low	40.5	Very low	142 Å²	142	128 Å²	128	87%	0.871	65%	0.648	S	S	*	*				-173.4	149.4	101.9	25.6	0	0	0	0	117
193	A	37.6	Very low	41.8	Very low	83 Å²	83	129.6 Å²	129.6	69%	0.686	66%	0.659	S	S	*	*			trans	36.8	104.6	144.7	0	0	0	0	0	122.1
194	K	40.7	Very low	42.9	Very low	222 Å²	222	132.2 Å²	132.2	97%	0.965	66%	0.66	S	S	*	*			trans	-103.4	74.1	140.6	-89.2	176.1	179.7	165.6	0	111.7
195	Q	42.1	Very low	44.6	Very low	170 Å²	170	130.9 Å²	130.9	79%	0.794	66%	0.657	S	S	*	*			trans	-74.1	128.8	173	-176.7	-161.2	75.5	0	0	110.9
196	R	43.4	Very low	46.1	Very low	198 Å²	198	126.4 Å²	126.4	75%	0.747	64%	0.643	S	S	*	*			trans	164.5	140.3	156.3	-91	150.9	178.9	-149.7	-0.8	108.6
197	R	47.3	Very low	47.9	Very low	156 Å²	156	123 Å²	123	59%	0.589	62%	0.622	S	S	*	*			cis	-158.1	114.1	-1.1	-127.2	170.8	-51.8	-158.3	2.9	109.9
198	C	44.6	Very low	49.6	Very low	94 Å²	94	122.5 Å²	122.5	64%	0.635	62%	0.618	S	S	*	*			trans	-74.5	135.6	149.3	-70.5	0	0	0	0	106.8
199	R	56.5	Low	51.6	Low	170 Å²	170	115 Å²	115	64%	0.642	58%	0.582	S	S	*	*			trans	-136.1	20.7	-168.3	-152.3	-142.1	-93.8	-113.8	4.8	115
200	W	55.5	Low	52.6	Low	84 Å²	84	115 Å²	115	32%	0.318	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-138.9	121.6	174.2	-55.4	97.5	0	0	0	108.8	F209 F215	W200-F209 HydrophobicContact CB-CB 4.38Å; W200-F209 PolarHBondContact O-N 2.81Å; W200-F215 HydrophobicContact CB-CB 3.89Å; W200-F215 HydrophobicContact CB-CD1 4.25Å; W200-F215 HydrophobicContact CB-CD2 3.92Å; W200-F215 HydrophobicContact CB-CG 3.75Å; W200-F215 HydrophobicContact CD2-CD1 4.47Å; W200-F215 HydrophobicContact CE3-CD1 4.02Å; W200-F215 AromaticContact CE3-CE1 3.99Å; W200-F215 HydrophobicContact CE3-CE1 3.99Å; W200-F215 HydrophobicContact CG-CB 4.47Å; W200-F215 HydrophobicContact CG-CG 4.42Å
201	E	67.6	Low	54.2	Low	98 Å²	98	112.8 Å²	112.8	46%	0.458	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-137.2	131.1	-178.4	-178.7	167.4	-170	0	0	108.5	Q207 K208 F215	E201-Q207 WeakPolarHBondContact CA-O 3.34Å; E201-K208 HydrophobicContact CB-CG 4.17Å; E201-K208 HydrophobicContact CG-CG 3.85Å; E201-K208 WeakPolarHBondContact OE1-CE 3.42Å; E201-K208 IonicContact OE1-NZ 2.65Å; E201-K208 WeakPolarHBondContact OE2-CE 3.38Å; E201-K208 IonicContact OE2-NZ 3.72Å; E201-F215 WeakPolarHBondContact O-CE2 3.34Å
202	C	71.9	Confident	55.3	Low	2 Å²	2	115.5 Å²	115.5	1%	0.014	56%	0.559	C	S	.	*			trans	-75.4	126.9	177.6	163.1	0	0	0	0	109.8	E204 C205 G206 Q207 F209 F215 H218 H222	C202-E204 PolarHBondContact SG-N 2.76Å; C202-E204 VanDerWaalsContact SG-N 3.4Å; C202-E204 PolarHBondContact SG-OE2 2.76Å; C202-C205 PolarHBondContact SG-N 2.56Å; C202-G206 VanDerWaalsContact O-CA 3.3Å; C202-G206 WeakPolarHBondContact O-CA 3.3Å; C202-G206 PolarHBondContact O-N 3.4Å; C202-Q207 PolarHBondContact N-O 3.34Å; C202-F209 HydrophobicContact CB-CE2 4.31Å; C202-F215 HydrophobicContact CB-CE2 4.44Å; C202-H218 VanDerWaalsContact CB-NE2 3.34Å; C202-H218 WeakPolarHBondContact CB-NE2 3.16Å; C202-H218 PolarHBondContact SG-NE2 2.99Å; C202-H222 PolarHBondContact SG-NE2 3.49Å
203	K	58.3	Low	56.7	Low	205 Å²	205	116.2 Å²	116.2	89%	0.891	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-28.8	179.7	-69.9	-170.9	175	-171.9	0	112.1
204	E	55.8	Low	58	Low	122 Å²	122	116.8 Å²	116.8	57%	0.57	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-29.4	-179.5	-56.7	81.7	-173.7	0	0	113.3	C202 H222	C202-E204 PolarHBondContact SG-N 2.76Å; C202-E204 VanDerWaalsContact SG-N 3.4Å; C202-E204 PolarHBondContact SG-OE2 2.76Å; E204-H222 IonicContact OE2-CD2 3.14Å
205	C	68.3	Low	59.6	Low	60 Å²	60	107.6 Å²	107.6	41%	0.405	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.3	3.2	-175.5	83.9	0	0	0	0	117	C202 Q207 H218	C202-C205 PolarHBondContact SG-N 2.56Å; C205-Q207 PolarHBondContact O-N 2.81Å; C205-H218 PolarHBondContact SG-CE1 3.45Å; C205-H218 PolarHBondContact SG-NE2 2.88Å
206	G	63	Low	60.5	Low	41 Å²	41	103.5 Å²	103.5	42%	0.423	49%	0.486	S	S	.	.			trans	69.5	8	175.2	0	0	0	0	0	116.2	C202 K208	C202-G206 VanDerWaalsContact O-CA 3.3Å; C202-G206 WeakPolarHBondContact O-CA 3.3Å; C202-G206 PolarHBondContact O-N 3.4Å; G206-K208 PolarHBondContact O-N 3.21Å
207	Q	69.5	Low	61.6	Low	73 Å²	73	99.2 Å²	99.2	34%	0.341	48%	0.477	S	S	.	.			trans	-72.4	129.1	176.2	-72.7	-157.5	3.3	0	0	111.8	E201 C202 C205 F209 Q413	E201-Q207 WeakPolarHBondContact CA-O 3.34Å; C202-Q207 PolarHBondContact N-O 3.34Å; C205-Q207 PolarHBondContact O-N 2.81Å; Q207-F209 HydrophobicContact CB-CD2 4.44Å; Q207-F209 HydrophobicContact CB-CE2 3.52Å; Q207-F209 HydrophobicContact CB-CZ 3.65Å; Q207-F209 WeakPolarHBondContact O-CD2 3.32Å; Q207-F209 WeakPolarHBondContact O-CE2 3.33Å; Q207-Q413 VanDerWaalsContact NE2-NE2 3.11Å
208	K	69.6	Low	62.8	Low	148 Å²	148	93.3 Å²	93.3	64%	0.643	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	123.1	179.9	-69.9	170.8	-179.6	171.8	0	110.4	E201 G206	E201-K208 HydrophobicContact CB-CG 4.17Å; E201-K208 HydrophobicContact CG-CG 3.85Å; E201-K208 WeakPolarHBondContact OE1-CE 3.42Å; E201-K208 IonicContact OE1-NZ 2.65Å; E201-K208 WeakPolarHBondContact OE2-CE 3.38Å; E201-K208 IonicContact OE2-NZ 3.72Å; G206-K208 PolarHBondContact O-N 3.21Å
209	F	72.8	Confident	63.6	Low	17 Å²	17	96 Å²	96	8%	0.075	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	136	-175.6	-61.3	-88.4	0	0	0	111.2	W200 C202 Q207 M214 F215 H218	W200-F209 HydrophobicContact CB-CB 4.38Å; W200-F209 PolarHBondContact O-N 2.81Å; C202-F209 HydrophobicContact CB-CE2 4.31Å; Q207-F209 HydrophobicContact CB-CD2 4.44Å; Q207-F209 HydrophobicContact CB-CE2 3.52Å; Q207-F209 HydrophobicContact CB-CZ 3.65Å; Q207-F209 WeakPolarHBondContact O-CD2 3.32Å; Q207-F209 WeakPolarHBondContact O-CE2 3.33Å; F209-M214 HydrophobicContact CD1-CB 3.89Å; F209-M214 HydrophobicContact CD1-CE 4.35Å; F209-F215 HydrophobicContact CB-CB 4.04Å; F209-F215 HydrophobicContact CD2-CB 4.26Å; F209-F215 AromaticContact CD2-CD2 3.92Å; F209-F215 HydrophobicContact CD2-CD2 3.92Å; F209-F215 HydrophobicContact CE2-CD2 4.47Å; F209-F215 HydrophobicContact CG-CB 4.18Å; F209-H218 HydrophobicContact CE1-CB 4.18Å; F209-H218 HydrophobicContact CE2-CB 4.24Å; F209-H218 AromaticContact CE2-CD2 3.37Å; F209-H218 WeakPolarHBondContact CE2-CD2 3.14Å; F209-H218 AromaticContact CE2-CG 3.87Å; F209-H218 AromaticContact CE2-NE2 3.99Å; F209-H218 HydrophobicContact CZ-CB 3.72Å; F209-H218 AromaticContact CZ-CD2 3.42Å; F209-H218 VanDerWaalsContact CZ-CD2 3.42Å; F209-H218 WeakPolarHBondContact CZ-CD2 3.35Å; F209-H218 AromaticContact CZ-CG 3.43Å; F209-H218 VanDerWaalsContact CZ-CG 3.43Å
210	S	49.6	Very low	63.9	Low	90 Å²	90	93.9 Å²	93.9	63%	0.629	45%	0.45	S	S	*	.	S	Bend	trans	-84.1	-20.6	174.6	52.6	0	0	0	0	113.2
211	Q	60.2	Low	63.7	Low	108 Å²	108	93.9 Å²	93.9	51%	0.505	45%	0.452	S	S	.	.	S	Bend	trans	-122.7	132.5	-177.1	-67.8	-179.7	-16.5	0	0	111.3	E213 M214 F215	Q211-E213 VanDerWaalsContact C-N 3.27Å; Q211-E213 PolarHBondContact O-N 3.22Å; Q211-M214 HydrophobicContact CB-CG 4.44Å; Q211-M214 HydrophobicContact CB-SD 4.39Å; Q211-M214 PolarHBondContact O-N 2.8Å; Q211-F215 PolarHBondContact O-N 3.04Å
212	R	57.1	Low	63.5	Low	143 Å²	143	90.7 Å²	90.7	54%	0.54	44%	0.438	S	S	.	.	H	α-helix	trans	-61.9	-33.7	-179.9	179.5	-178.6	-81	-177.7	-5.9	112.4	F215 N216	R212-F215 PolarHBondContact O-N 3.05Å; R212-N216 WeakPolarHBondContact O-CB 3.35Å; R212-N216 VanDerWaalsContact O-CG 3.24Å; R212-N216 PolarHBondContact O-N 2.78Å; R212-N216 PolarHBondContact O-OD1 2.62Å
213	E	59.6	Low	62.4	Low	156 Å²	156	93.5 Å²	93.5	73%	0.729	46%	0.461	S	S	*	.	H	α-helix	trans	-63.1	-44.1	178.4	-70.6	150.6	-145.5	0	0	112.1	Q211 N216 L217	Q211-E213 VanDerWaalsContact C-N 3.27Å; Q211-E213 PolarHBondContact O-N 3.22Å; E213-N216 PolarHBondContact O-N 3.03Å; E213-L217 WeakPolarHBondContact O-CB 3.11Å; E213-L217 PolarHBondContact O-N 3.05Å
214	M	64.2	Low	61.9	Low	96 Å²	96	89 Å²	89	47%	0.473	44%	0.443	S	S	.	.	H	α-helix	trans	-66.4	-40	174.7	-68.4	174.3	61.3	0	0	111.9	F209 Q211 H218	F209-M214 HydrophobicContact CD1-CB 3.89Å; F209-M214 HydrophobicContact CD1-CE 4.35Å; Q211-M214 HydrophobicContact CB-CG 4.44Å; Q211-M214 HydrophobicContact CB-SD 4.39Å; Q211-M214 PolarHBondContact O-N 2.8Å; M214-H218 WeakPolarHBondContact O-CB 3.32Å; M214-H218 PolarHBondContact O-N 2.88Å
215	F	73.9	Confident	61.5	Low	29 Å²	29	88.5 Å²	88.5	13%	0.127	44%	0.44	C	S	.	.	H	α-helix	trans	-62.8	-45	174.6	174	-103.4	0	0	0	112.2	W200 E201 C202 F209 Q211 R212 H218 R219	W200-F215 HydrophobicContact CB-CB 3.89Å; W200-F215 HydrophobicContact CB-CD1 4.25Å; W200-F215 HydrophobicContact CB-CD2 3.92Å; W200-F215 HydrophobicContact CB-CG 3.75Å; W200-F215 HydrophobicContact CD2-CD1 4.47Å; W200-F215 HydrophobicContact CE3-CD1 4.02Å; W200-F215 AromaticContact CE3-CE1 3.99Å; W200-F215 HydrophobicContact CE3-CE1 3.99Å; W200-F215 HydrophobicContact CG-CB 4.47Å; W200-F215 HydrophobicContact CG-CG 4.42Å; E201-F215 WeakPolarHBondContact O-CE2 3.34Å; C202-F215 HydrophobicContact CB-CE2 4.44Å; F209-F215 HydrophobicContact CB-CB 4.04Å; F209-F215 HydrophobicContact CD2-CB 4.26Å; F209-F215 AromaticContact CD2-CD2 3.92Å; F209-F215 HydrophobicContact CD2-CD2 3.92Å; F209-F215 HydrophobicContact CE2-CD2 4.47Å; F209-F215 HydrophobicContact CG-CB 4.18Å; Q211-F215 PolarHBondContact O-N 3.04Å; R212-F215 PolarHBondContact O-N 3.05Å; F215-H218 PolarHBondContact O-N 3.15Å; F215-R219 PolarHBondContact O-N 2.84Å
216	N	62.8	Low	60.1	Low	84 Å²	84	91.4 Å²	91.4	45%	0.449	45%	0.452	S	S	.	.	H	α-helix	trans	-65.5	-43.8	178.7	-74.6	4.1	0	0	0	111.4	R212 E213 H218 R219 H220	R212-N216 WeakPolarHBondContact O-CB 3.35Å; R212-N216 VanDerWaalsContact O-CG 3.24Å; R212-N216 PolarHBondContact O-N 2.78Å; R212-N216 PolarHBondContact O-OD1 2.62Å; E213-N216 PolarHBondContact O-N 3.03Å; N216-H218 VanDerWaalsContact C-N 3.31Å; N216-H218 PolarHBondContact O-N 3.46Å; N216-R219 PolarHBondContact O-N 2.97Å; N216-H220 WeakPolarHBondContact O-CB 3.17Å; N216-H220 PolarHBondContact O-N 3.07Å
217	L	65.8	Low	59.4	Low	108 Å²	108	96.7 Å²	96.7	57%	0.565	47%	0.465	S	S	*	.	H	α-helix	trans	-61.4	-41.1	174.7	-179.5	62.3	0	0	0	111.3	E213 H220 F221	E213-L217 WeakPolarHBondContact O-CB 3.11Å; E213-L217 PolarHBondContact O-N 3.05Å; L217-H220 WeakPolarHBondContact O-CB 2.94Å; L217-H220 PolarHBondContact O-N 2.94Å; L217-F221 HydrophobicContact CD1-CE2 4.15Å; L217-F221 HydrophobicContact CG-CE2 4.08Å; L217-F221 VanDerWaalsContact O-CD2 3.24Å; L217-F221 WeakPolarHBondContact O-CD2 3.41Å; L217-F221 PolarHBondContact O-N 2.71Å
218	H	72.8	Confident	58.5	Low	31 Å²	31	98.7 Å²	98.7	14%	0.144	48%	0.478	C	S	.	.	H	α-helix	trans	-66.5	-42.3	176.2	175.2	63.7	0	0	0	112.8	C202 C205 F209 M214 F215 N216 H220 F221 H222	C202-H218 VanDerWaalsContact CB-NE2 3.34Å; C202-H218 WeakPolarHBondContact CB-NE2 3.16Å; C202-H218 PolarHBondContact SG-NE2 2.99Å; C205-H218 PolarHBondContact SG-CE1 3.45Å; C205-H218 PolarHBondContact SG-NE2 2.88Å; F209-H218 HydrophobicContact CE1-CB 4.18Å; F209-H218 HydrophobicContact CE2-CB 4.24Å; F209-H218 AromaticContact CE2-CD2 3.37Å; F209-H218 WeakPolarHBondContact CE2-CD2 3.14Å; F209-H218 AromaticContact CE2-CG 3.87Å; F209-H218 AromaticContact CE2-NE2 3.99Å; F209-H218 HydrophobicContact CZ-CB 3.72Å; F209-H218 AromaticContact CZ-CD2 3.42Å; F209-H218 VanDerWaalsContact CZ-CD2 3.42Å; F209-H218 WeakPolarHBondContact CZ-CD2 3.35Å; F209-H218 AromaticContact CZ-CG 3.43Å; F209-H218 VanDerWaalsContact CZ-CG 3.43Å; M214-H218 WeakPolarHBondContact O-CB 3.32Å; M214-H218 PolarHBondContact O-N 2.88Å; F215-H218 PolarHBondContact O-N 3.15Å; N216-H218 VanDerWaalsContact C-N 3.31Å; N216-H218 PolarHBondContact O-N 3.46Å; H218-H220 PolarHBondContact O-N 2.67Å; H218-F221 WeakPolarHBondContact O-CB 3.41Å; H218-F221 PolarHBondContact O-N 3.47Å; H218-F221 VanDerWaalsContact O-N 3.07Å; H218-H222 AromaticContact CE1-CD2 3.93Å; H218-H222 AromaticContact CE1-NE2 3.29Å; H218-H222 PolarHBondContact CE1-NE2 3.3Å; H218-H222 VanDerWaalsContact CE1-NE2 3.29Å; H218-H222 AromaticContact NE2-CD2 3.74Å; H218-H222 AromaticContact NE2-NE2 3.19Å; H218-H222 PolarHBondContact NE2-NE2 2.91Å; H218-H222 VanDerWaalsContact NE2-NE2 3.19Å; H218-H222 PolarHBondContact O-CD2 3.39Å; H218-H222 PolarHBondContact O-N 3.4Å
219	R	61.8	Low	57.7	Low	151 Å²	151	98.7 Å²	98.7	57%	0.57	48%	0.484	S	S	*	.	H	α-helix	trans	-64.7	-28.7	172.6	-156.9	-174.7	79	161.5	6.5	112.2	F215 N216 F221 H222 A223	F215-R219 PolarHBondContact O-N 2.84Å; N216-R219 PolarHBondContact O-N 2.97Å; R219-F221 VanDerWaalsContact C-N 3.29Å; R219-H222 PolarHBondContact O-N 2.82Å; R219-A223 WeakPolarHBondContact O-CB 3.13Å; R219-A223 PolarHBondContact O-N 3.19Å
220	H	61.8	Low	56.7	Low	126 Å²	126	100.6 Å²	100.6	58%	0.583	50%	0.498	S	S	*	.	H	α-helix	trans	-72.4	-20.8	173.9	-156.3	-29.5	0	0	0	112.8	N216 L217 H218 H224	N216-H220 WeakPolarHBondContact O-CB 3.17Å; N216-H220 PolarHBondContact O-N 3.07Å; L217-H220 WeakPolarHBondContact O-CB 2.94Å; L217-H220 PolarHBondContact O-N 2.94Å; H218-H220 PolarHBondContact O-N 2.67Å; H220-H224 PolarHBondContact O-N 2.74Å
221	F	52.3	Low	57.1	Low	83 Å²	83	97.9 Å²	97.9	36%	0.364	48%	0.479	S	S	.	.	H	α-helix	trans	-73.5	-45.4	167.6	-79.4	-73.9	0	0	0	111.4	L217 H218 R219 A223 H224 E225 I392	L217-F221 HydrophobicContact CD1-CE2 4.15Å; L217-F221 HydrophobicContact CG-CE2 4.08Å; L217-F221 VanDerWaalsContact O-CD2 3.24Å; L217-F221 WeakPolarHBondContact O-CD2 3.41Å; L217-F221 PolarHBondContact O-N 2.71Å; H218-F221 WeakPolarHBondContact O-CB 3.41Å; H218-F221 PolarHBondContact O-N 3.47Å; H218-F221 VanDerWaalsContact O-N 3.07Å; R219-F221 VanDerWaalsContact C-N 3.29Å; F221-A223 VanDerWaalsContact C-N 3.33Å; F221-A223 PolarHBondContact O-N 2.76Å; F221-H224 CarbonylContact O-C 3.21Å; F221-H224 WeakPolarHBondContact O-CA 3.27Å; F221-H224 PolarHBondContact O-N 3.12Å; F221-E225 PolarHBondContact O-N 3.4Å; F221-I392 HydrophobicContact CE1-CD1 4.5Å; F221-I392 HydrophobicContact CZ-CD1 4.3Å
222	H	63.3	Low	56.7	Low	32 Å²	32	96.5 Å²	96.5	15%	0.148	48%	0.478	C	S	.	.	H	α-helix	trans	-56.9	-45.8	172.8	-70.1	-68.2	0	0	0	112	C202 E204 H218 R219 H224 E225 D226	C202-H222 PolarHBondContact SG-NE2 3.49Å; E204-H222 IonicContact OE2-CD2 3.14Å; H218-H222 AromaticContact CE1-CD2 3.93Å; H218-H222 AromaticContact CE1-NE2 3.29Å; H218-H222 PolarHBondContact CE1-NE2 3.3Å; H218-H222 VanDerWaalsContact CE1-NE2 3.29Å; H218-H222 AromaticContact NE2-CD2 3.74Å; H218-H222 AromaticContact NE2-NE2 3.19Å; H218-H222 PolarHBondContact NE2-NE2 2.91Å; H218-H222 VanDerWaalsContact NE2-NE2 3.19Å; H218-H222 PolarHBondContact O-CD2 3.39Å; H218-H222 PolarHBondContact O-N 3.4Å; R219-H222 PolarHBondContact O-N 2.82Å; H222-H224 PolarHBondContact O-N 3.39Å; H222-E225 IonicContact ND1-OE2 2.58Å; H222-E225 CarbonylContact O-C 3.59Å; H222-E225 WeakPolarHBondContact O-CA 3.43Å; H222-E225 PolarHBondContact O-N 3.07Å; H222-D226 PolarHBondContact O-N 3.36Å
223	A	48	Very low	57.4	Low	60 Å²	60	89.8 Å²	89.8	50%	0.496	45%	0.452	S	S	.	.	H	α-helix	trans	-64.8	-0.6	174.2	0	0	0	0	0	115.1	R219 F221 D226	R219-A223 WeakPolarHBondContact O-CB 3.13Å; R219-A223 PolarHBondContact O-N 3.19Å; F221-A223 VanDerWaalsContact C-N 3.33Å; F221-A223 PolarHBondContact O-N 2.76Å; A223-D226 WeakPolarHBondContact CA-OD2 3.31Å
224	H	49.1	Very low	57.6	Low	112 Å²	112	91.1 Å²	91.1	52%	0.519	46%	0.456	S	S	.	.	H	α-helix	trans	-116.2	-11.7	169.5	-139.8	-29.5	0	0	0	112.4	H220 F221 H222 E227	H220-H224 PolarHBondContact O-N 2.74Å; F221-H224 CarbonylContact O-C 3.21Å; F221-H224 WeakPolarHBondContact O-CA 3.27Å; F221-H224 PolarHBondContact O-N 3.12Å; H222-H224 PolarHBondContact O-N 3.39Å; H224-E227 IonicContact CE1-OE2 3.14Å; H224-E227 PolarHBondContact CE1-OE2 2.75Å; H224-E227 IonicContact ND1-OE2 2.74Å; H224-E227 PolarHBondContact ND1-OE2 2.88Å
225	E	46.9	Very low	57.8	Low	111 Å²	111	90.2 Å²	90.2	52%	0.519	45%	0.45	S	S	.	.	H	α-helix	trans	-82.4	-13.7	164.2	-65.8	-176.6	171.6	0	0	111.6	F221 H222 E227 L228	F221-E225 PolarHBondContact O-N 3.4Å; H222-E225 IonicContact ND1-OE2 2.58Å; H222-E225 CarbonylContact O-C 3.59Å; H222-E225 WeakPolarHBondContact O-CA 3.43Å; H222-E225 PolarHBondContact O-N 3.07Å; E225-E227 PolarHBondContact O-N 3.43Å; E225-L228 HydrophobicContact CG-CD1 4.33Å; E225-L228 CarbonylContact O-C 3.54Å; E225-L228 VanDerWaalsContact O-CA 3.23Å; E225-L228 WeakPolarHBondContact O-CA 3.32Å; E225-L228 VanDerWaalsContact O-CB 3.26Å; E225-L228 WeakPolarHBondContact O-CB 3.18Å; E225-L228 PolarHBondContact O-N 3.36Å
226	D	38.7	Very low	57.9	Low	121 Å²	121	91.2 Å²	91.2	65%	0.647	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-64.6	-25.6	166.2	-72.2	-45.1	0	0	0	112.7	H222 A223 L228	H222-D226 PolarHBondContact O-N 3.36Å; A223-D226 WeakPolarHBondContact CA-OD2 3.31Å; D226-L228 PolarHBondContact O-N 3.08Å
227	E	47.2	Very low	58.1	Low	151 Å²	151	89.8 Å²	89.8	71%	0.706	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-75.6	-0.8	165.7	-68	-167.5	141.5	0	0	113	H224 E225	H224-E227 IonicContact CE1-OE2 3.14Å; H224-E227 PolarHBondContact CE1-OE2 2.75Å; H224-E227 IonicContact ND1-OE2 2.74Å; H224-E227 PolarHBondContact ND1-OE2 2.88Å; E225-E227 PolarHBondContact O-N 3.43Å
228	L	51.7	Low	58.2	Low	116 Å²	116	89.2 Å²	89.2	61%	0.607	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-111.9	34.2	175.5	-56.8	178.5	0	0	0	112.4	E225 D226	E225-L228 HydrophobicContact CG-CD1 4.33Å; E225-L228 CarbonylContact O-C 3.54Å; E225-L228 VanDerWaalsContact O-CA 3.23Å; E225-L228 WeakPolarHBondContact O-CA 3.32Å; E225-L228 VanDerWaalsContact O-CB 3.26Å; E225-L228 WeakPolarHBondContact O-CB 3.18Å; E225-L228 PolarHBondContact O-N 3.36Å; D226-L228 PolarHBondContact O-N 3.08Å
229	L	51.5	Low	57.7	Low	148 Å²	148	92.1 Å²	92.1	78%	0.775	48%	0.482	S	S	*	.	S	Bend	trans	-40.1	118.3	151.8	-90.6	167.8	0	0	0	108.6	P231	L229-P231 VanDerWaalsContact O-CD 3.22Å; L229-P231 WeakPolarHBondContact O-CD 3.36Å
230	P	52.6	Low	57.8	Low	57 Å²	57	86.8 Å²	86.8	37%	0.37	46%	0.463	S	S	.	.			trans	-64.2	110.1	-155.9	21.2	-33.5	0	0	0	110.4	T232 T239 F240	P230-T232 PolarHBondContact O-N 2.91Å; P230-T239 HydrophobicContact CG-CG2 3.98Å; P230-F240 CarbonylContact C-O 3.44Å
231	P	58.4	Low	57.6	Low	33 Å²	33	89.3 Å²	89.3	21%	0.214	48%	0.475	C	S	.	.			trans	-44.5	109.3	-158.4	-4.6	-14.3	0	0	0	113.9	L229 F240 R243 L246	L229-P231 VanDerWaalsContact O-CD 3.22Å; L229-P231 WeakPolarHBondContact O-CD 3.36Å; P231-F240 WeakPolarHBondContact CD-O 3.47Å; P231-F240 WeakPolarHBondContact CG-O 3.3Å; P231-F240 PolarHBondContact O-N 2.89Å; P231-F240 VanDerWaalsContact O-N 3.1Å; P231-R243 HydrophobicContact CG-CB 4.44Å; P231-L246 HydrophobicContact CB-CB 4.15Å; P231-L246 HydrophobicContact CB-CD2 3.53Å; P231-L246 HydrophobicContact CB-CG 4.43Å
232	T	51.8	Low	58.1	Low	79 Å²	79	91.1 Å²	91.1	49%	0.485	49%	0.485	S	S	.	.	B	Isolated β-bridge	trans	-76.6	135.8	179.5	41.4	0	0	0	0	111	P230 K234 L238 T239	P230-T232 PolarHBondContact O-N 2.91Å; T232-K234 PolarHBondContact O-N 3.08Å; T232-L238 CarbonylContact C-O 3.5Å; T232-L238 WeakPolarHBondContact CA-O 3.23Å; T232-T239 HydrophobicContact CG2-CG2 3.53Å
233	C	71	Confident	58	Low	1 Å²	1	98.9 Å²	98.9	1%	0.007	51%	0.513	C	S	.	.			trans	-73.9	121.6	165	-169.5	0	0	0	0	109.1	E235 C236 G237 L238 F240 L246	C233-E235 PolarHBondContact O-N 3.22Å; C233-C236 VanDerWaalsContact CB-SG 3.55Å; C233-C236 PolarHBondContact O-N 3.01Å; C233-G237 WeakPolarHBondContact O-CA 3.46Å; C233-G237 PolarHBondContact O-N 3.1Å; C233-L238 PolarHBondContact N-O 3.1Å; C233-F240 HydrophobicContact CB-CE2 4.14Å; C233-L246 HydrophobicContact CB-CD1 3.66Å
234	K	64.5	Low	58.5	Low	185 Å²	185	99.7 Å²	99.7	80%	0.804	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-26.3	-179.9	-69.8	-165.3	174	-166.8	0	112.4	T232	T232-K234 PolarHBondContact O-N 3.08Å
235	E	67.7	Low	59.5	Low	76 Å²	76	96.8 Å²	96.8	36%	0.355	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-17.8	178.2	-60.3	86.2	-96.6	0	0	114.3	C233 R250	C233-E235 PolarHBondContact O-N 3.22Å; E235-R250 IonicContact OE1-CZ 3.18Å; E235-R250 IonicContact OE1-NE 2.88Å; E235-R250 PolarHBondContact OE1-NE 3.07Å; E235-R250 IonicContact OE1-NH2 2.67Å; E235-R250 PolarHBondContact OE1-NH2 3.2Å; E235-R250 WeakPolarHBondContact OE2-CG 3.46Å; E235-R250 IonicContact OE2-CZ 3.93Å; E235-R250 IonicContact OE2-NE 2.99Å; E235-R250 PolarHBondContact OE2-NE 2.89Å
236	C	75.9	Confident	60.9	Low	51 Å²	51	92.7 Å²	92.7	35%	0.345	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.4	3.5	-174.1	73.8	0	0	0	0	116.5	C233 L238 H249 H253	C233-C236 VanDerWaalsContact CB-SG 3.55Å; C233-C236 PolarHBondContact O-N 3.01Å; C236-L238 PolarHBondContact O-N 3.25Å; C236-L238 VanDerWaalsContact O-N 3.1Å; C236-H249 PolarHBondContact SG-NE2 2.87Å; C236-H253 VanDerWaalsContact CB-NE2 3.32Å; C236-H253 WeakPolarHBondContact CB-NE2 3.36Å
237	G	66.6	Low	62.6	Low	53 Å²	53	91.1 Å²	91.1	55%	0.546	48%	0.479	S	S	.	.			trans	74.2	-10.8	177.7	0	0	0	0	0	116.5	C233 T239	C233-G237 WeakPolarHBondContact O-CA 3.46Å; C233-G237 PolarHBondContact O-N 3.1Å; G237-T239 PolarHBondContact O-N 3.42Å
238	L	68.9	Low	64	Low	97 Å²	97	91.2 Å²	91.2	51%	0.508	48%	0.477	S	S	.	.			trans	-63.9	130.5	-175.6	-67.8	177.8	0	0	0	112.6	T232 C233 C236 F240	T232-L238 CarbonylContact C-O 3.5Å; T232-L238 WeakPolarHBondContact CA-O 3.23Å; C233-L238 PolarHBondContact N-O 3.1Å; C236-L238 PolarHBondContact O-N 3.25Å; C236-L238 VanDerWaalsContact O-N 3.1Å; L238-F240 HydrophobicContact CB-CE2 3.57Å; L238-F240 HydrophobicContact CB-CZ 3.81Å; L238-F240 HydrophobicContact CD1-CZ 4.28Å; L238-F240 VanDerWaalsContact O-CD2 3.27Å; L238-F240 WeakPolarHBondContact O-CD2 3.35Å; L238-F240 VanDerWaalsContact O-CE2 3.25Å; L238-F240 WeakPolarHBondContact O-CE2 3.27Å
239	T	61.2	Low	65.4	Low	91 Å²	91	87.1 Å²	87.1	56%	0.558	46%	0.455	S	S	*	.	B	Isolated β-bridge	trans	-87.3	130.6	177.5	45	0	0	0	0	111.5	P230 T232 G237	P230-T239 HydrophobicContact CG-CG2 3.98Å; T232-T239 HydrophobicContact CG2-CG2 3.53Å; G237-T239 PolarHBondContact O-N 3.42Å
240	F	64.1	Low	66.5	Low	39 Å²	39	85.7 Å²	85.7	17%	0.171	44%	0.439	C	S	.	.			trans	-118.8	125.7	-179.4	-66.8	-86.8	0	0	0	112.3	P230 P231 C233 L238 H242 L246 H249	P230-F240 CarbonylContact C-O 3.44Å; P231-F240 WeakPolarHBondContact CD-O 3.47Å; P231-F240 WeakPolarHBondContact CG-O 3.3Å; P231-F240 PolarHBondContact O-N 2.89Å; P231-F240 VanDerWaalsContact O-N 3.1Å; C233-F240 HydrophobicContact CB-CE2 4.14Å; L238-F240 HydrophobicContact CB-CE2 3.57Å; L238-F240 HydrophobicContact CB-CZ 3.81Å; L238-F240 HydrophobicContact CD1-CZ 4.28Å; L238-F240 VanDerWaalsContact O-CD2 3.27Å; L238-F240 WeakPolarHBondContact O-CD2 3.35Å; L238-F240 VanDerWaalsContact O-CE2 3.25Å; L238-F240 WeakPolarHBondContact O-CE2 3.27Å; F240-H242 PolarHBondContact O-N 3.12Å; F240-L246 HydrophobicContact CB-CB 4.09Å; F240-L246 HydrophobicContact CD2-CB 4.14Å; F240-L246 HydrophobicContact CD2-CD1 3.91Å; F240-L246 HydrophobicContact CE2-CD1 4.25Å; F240-L246 HydrophobicContact CG-CB 4.25Å; F240-H249 HydrophobicContact CE1-CB 3.94Å; F240-H249 AromaticContact CE1-CG 3.99Å; F240-H249 HydrophobicContact CE2-CB 4.14Å; F240-H249 AromaticContact CE2-CD2 3.19Å; F240-H249 WeakPolarHBondContact CE2-CD2 3.39Å; F240-H249 AromaticContact CE2-CG 3.74Å; F240-H249 AromaticContact CE2-NE2 3.81Å; F240-H249 HydrophobicContact CZ-CB 3.66Å; F240-H249 AromaticContact CZ-CD2 3.18Å; F240-H249 WeakPolarHBondContact CZ-CD2 3.08Å; F240-H249 AromaticContact CZ-CG 3.26Å; F240-H249 AromaticContact CZ-ND1 3.84Å; F240-H249 AromaticContact CZ-NE2 3.68Å
241	Q	58.2	Low	67.4	Low	179 Å²	179	86.9 Å²	86.9	84%	0.836	44%	0.443	S	S	*	.	S	Bend	trans	-60.9	-18.6	178.3	-71	-179.8	-18.8	0	0	114.4
242	H	63.2	Low	68.1	Low	121 Å²	121	90.3 Å²	90.3	56%	0.56	46%	0.456	S	S	*	.	S	Bend	trans	-136	135	178.9	-66	-26.7	0	0	0	111.1	F240 S244 S245 L246	F240-H242 PolarHBondContact O-N 3.12Å; H242-S244 PolarHBondContact O-N 3.38Å; H242-S245 WeakPolarHBondContact O-CA 3.19Å; H242-S245 WeakPolarHBondContact O-CB 3.18Å; H242-S245 PolarHBondContact O-N 3.4Å; H242-L246 PolarHBondContact O-N 3.48Å
243	R	60.9	Low	69.2	Low	196 Å²	196	89.4 Å²	89.4	74%	0.74	45%	0.446	S	S	*	.	H	α-helix	trans	-59.9	-28.3	177.5	-167.9	173.4	-176.7	139.7	-1.5	113.1	P231 S245 L246 I247	P231-R243 HydrophobicContact CG-CB 4.44Å; R243-S245 VanDerWaalsContact C-N 3.35Å; R243-L246 PolarHBondContact O-N 3.21Å; R243-I247 HydrophobicContact CG-CD1 4.12Å; R243-I247 WeakPolarHBondContact O-CB 3.34Å; R243-I247 WeakPolarHBondContact O-CD1 3.36Å; R243-I247 VanDerWaalsContact O-CG1 3.23Å; R243-I247 WeakPolarHBondContact O-CG1 3.41Å; R243-I247 PolarHBondContact O-N 3.46Å
244	S	59.3	Low	69.1	Low	76 Å²	76	94.8 Å²	94.8	53%	0.531	47%	0.469	S	S	.	.	H	α-helix	trans	-68.7	-30.5	171.7	48.2	0	0	0	0	113.3	H242 K248	H242-S244 PolarHBondContact O-N 3.38Å; S244-K248 WeakPolarHBondContact O-CG 3.25Å; S244-K248 PolarHBondContact O-N 3.24Å; S244-K248 VanDerWaalsContact O-N 3.07Å
245	S	69.7	Low	69.1	Low	52 Å²	52	91 Å²	91	36%	0.364	46%	0.455	S	S	.	.	H	α-helix	trans	-75	-41.4	172	-56.6	0	0	0	0	111.2	H242 R243 K248 H249	H242-S245 WeakPolarHBondContact O-CA 3.19Å; H242-S245 WeakPolarHBondContact O-CB 3.18Å; H242-S245 PolarHBondContact O-N 3.4Å; R243-S245 VanDerWaalsContact C-N 3.35Å; S245-K248 PolarHBondContact O-N 2.74Å; S245-H249 VanDerWaalsContact O-CB 3.27Å; S245-H249 WeakPolarHBondContact O-CB 3.38Å; S245-H249 PolarHBondContact O-N 2.76Å
246	L	76.3	Confident	68.9	Low	24 Å²	24	93.6 Å²	93.6	13%	0.126	47%	0.465	C	S	.	.	H	α-helix	trans	-58.5	-49.2	170.3	173.7	61.4	0	0	0	110.7	P231 C233 F240 H242 R243 K248 H249 R250	P231-L246 HydrophobicContact CB-CB 4.15Å; P231-L246 HydrophobicContact CB-CD2 3.53Å; P231-L246 HydrophobicContact CB-CG 4.43Å; C233-L246 HydrophobicContact CB-CD1 3.66Å; F240-L246 HydrophobicContact CB-CB 4.09Å; F240-L246 HydrophobicContact CD2-CB 4.14Å; F240-L246 HydrophobicContact CD2-CD1 3.91Å; F240-L246 HydrophobicContact CE2-CD1 4.25Å; F240-L246 HydrophobicContact CG-CB 4.25Å; H242-L246 PolarHBondContact O-N 3.48Å; R243-L246 PolarHBondContact O-N 3.21Å; L246-K248 VanDerWaalsContact C-N 3.34Å; L246-K248 PolarHBondContact O-N 2.93Å; L246-H249 CarbonylContact O-C 3.51Å; L246-H249 PolarHBondContact O-N 3.06Å; L246-H249 VanDerWaalsContact O-N 3.08Å; L246-R250 WeakPolarHBondContact O-CB 3.33Å; L246-R250 PolarHBondContact O-N 2.87Å
247	I	73.3	Confident	68.1	Low	89 Å²	89	96.2 Å²	96.2	46%	0.456	47%	0.471	S	S	.	.	H	α-helix	trans	-60.8	-43.1	-179.3	-70.3	163.2	0	0	0	111	R243 H249 R250 N251	R243-I247 HydrophobicContact CG-CD1 4.12Å; R243-I247 WeakPolarHBondContact O-CB 3.34Å; R243-I247 WeakPolarHBondContact O-CD1 3.36Å; R243-I247 VanDerWaalsContact O-CG1 3.23Å; R243-I247 WeakPolarHBondContact O-CG1 3.41Å; R243-I247 PolarHBondContact O-N 3.46Å; I247-H249 VanDerWaalsContact C-N 3.32Å; I247-H249 PolarHBondContact O-N 2.91Å; I247-R250 PolarHBondContact O-N 3.09Å; I247-N251 WeakPolarHBondContact O-CB 3.39Å; I247-N251 VanDerWaalsContact O-CG 3.3Å; I247-N251 PolarHBondContact O-N 3.14Å; I247-N251 PolarHBondContact O-OD1 3.07Å; I247-N251 VanDerWaalsContact O-OD1 3.04Å
248	K	77.1	Confident	67.6	Low	152 Å²	152	98 Å²	98	66%	0.661	47%	0.465	S	S	*	.	H	α-helix	trans	-61.6	-39.7	173.1	-78.9	-172.5	172.4	-165.3	0	112.9	S244 S245 L246 Q252	S244-K248 WeakPolarHBondContact O-CG 3.25Å; S244-K248 PolarHBondContact O-N 3.24Å; S244-K248 VanDerWaalsContact O-N 3.07Å; S245-K248 PolarHBondContact O-N 2.74Å; L246-K248 VanDerWaalsContact C-N 3.34Å; L246-K248 PolarHBondContact O-N 2.93Å; K248-Q252 VanDerWaalsContact O-CG 3.3Å; K248-Q252 WeakPolarHBondContact O-CG 3.03Å; K248-Q252 PolarHBondContact O-N 3.44Å
249	H	80.8	Confident	66.5	Low	30 Å²	30	96.8 Å²	96.8	14%	0.139	46%	0.462	C	S	.	.	H	α-helix	trans	-71.7	-34.1	179	174.2	63.7	0	0	0	112.8	C236 F240 S245 L246 I247 Q252 H253	C236-H249 PolarHBondContact SG-NE2 2.87Å; F240-H249 HydrophobicContact CE1-CB 3.94Å; F240-H249 AromaticContact CE1-CG 3.99Å; F240-H249 HydrophobicContact CE2-CB 4.14Å; F240-H249 AromaticContact CE2-CD2 3.19Å; F240-H249 WeakPolarHBondContact CE2-CD2 3.39Å; F240-H249 AromaticContact CE2-CG 3.74Å; F240-H249 AromaticContact CE2-NE2 3.81Å; F240-H249 HydrophobicContact CZ-CB 3.66Å; F240-H249 AromaticContact CZ-CD2 3.18Å; F240-H249 WeakPolarHBondContact CZ-CD2 3.08Å; F240-H249 AromaticContact CZ-CG 3.26Å; F240-H249 AromaticContact CZ-ND1 3.84Å; F240-H249 AromaticContact CZ-NE2 3.68Å; S245-H249 VanDerWaalsContact O-CB 3.27Å; S245-H249 WeakPolarHBondContact O-CB 3.38Å; S245-H249 PolarHBondContact O-N 2.76Å; L246-H249 CarbonylContact O-C 3.51Å; L246-H249 PolarHBondContact O-N 3.06Å; L246-H249 VanDerWaalsContact O-N 3.08Å; I247-H249 VanDerWaalsContact C-N 3.32Å; I247-H249 PolarHBondContact O-N 2.91Å; H249-Q252 CarbonylContact O-C 3.5Å; H249-Q252 WeakPolarHBondContact O-CA 3.41Å; H249-Q252 WeakPolarHBondContact O-CB 3.17Å; H249-Q252 PolarHBondContact O-N 3.34Å; H249-Q252 VanDerWaalsContact O-N 3.15Å; H249-H253 AromaticContact CD2-CD2 3.99Å; H249-H253 AromaticContact CE1-CD2 3.7Å; H249-H253 AromaticContact NE2-CD2 3.53Å; H249-H253 PolarHBondContact O-CD2 2.84Å; H249-H253 PolarHBondContact O-N 3.4Å
250	R	75.5	Confident	66.1	Low	118 Å²	118	97.3 Å²	97.3	45%	0.445	46%	0.461	S	S	.	.	H	α-helix	trans	-72.5	-37.4	173.8	-133.1	177.1	-178.8	-154.5	-6.9	111.8	E235 L246 I247 Q252 H253 K254	E235-R250 IonicContact OE1-CZ 3.18Å; E235-R250 IonicContact OE1-NE 2.88Å; E235-R250 PolarHBondContact OE1-NE 3.07Å; E235-R250 IonicContact OE1-NH2 2.67Å; E235-R250 PolarHBondContact OE1-NH2 3.2Å; E235-R250 WeakPolarHBondContact OE2-CG 3.46Å; E235-R250 IonicContact OE2-CZ 3.93Å; E235-R250 IonicContact OE2-NE 2.99Å; E235-R250 PolarHBondContact OE2-NE 2.89Å; L246-R250 WeakPolarHBondContact O-CB 3.33Å; L246-R250 PolarHBondContact O-N 2.87Å; I247-R250 PolarHBondContact O-N 3.09Å; R250-Q252 VanDerWaalsContact C-N 3.25Å; R250-Q252 PolarHBondContact O-N 2.82Å; R250-H253 WeakPolarHBondContact O-CB 3.36Å; R250-H253 PolarHBondContact O-N 3.37Å; R250-H253 VanDerWaalsContact O-N 3.07Å; R250-K254 PolarHBondContact O-N 3.47Å
251	N	71.8	Confident	65.4	Low	83 Å²	83	102.6 Å²	102.6	44%	0.444	49%	0.487	S	S	.	.	H	α-helix	trans	-62.6	-33.2	165.7	-72.9	30.1	0	0	0	111.1	I247 H253 K254 E255	I247-N251 WeakPolarHBondContact O-CB 3.39Å; I247-N251 VanDerWaalsContact O-CG 3.3Å; I247-N251 PolarHBondContact O-N 3.14Å; I247-N251 PolarHBondContact O-OD1 3.07Å; I247-N251 VanDerWaalsContact O-OD1 3.04Å; N251-H253 VanDerWaalsContact C-N 3.32Å; N251-K254 PolarHBondContact O-N 3.25Å; N251-E255 WeakPolarHBondContact O-CB 3.27Å; N251-E255 WeakPolarHBondContact O-CG 3.34Å; N251-E255 PolarHBondContact O-N 2.82Å
252	Q	73	Confident	64.8	Low	105 Å²	105	99.4 Å²	99.4	49%	0.491	48%	0.48	S	S	.	.	H	α-helix	trans	-74.4	-15.6	170.8	-75.1	172.6	-14.9	0	0	114.5	K248 H249 R250 K256	K248-Q252 VanDerWaalsContact O-CG 3.3Å; K248-Q252 WeakPolarHBondContact O-CG 3.03Å; K248-Q252 PolarHBondContact O-N 3.44Å; H249-Q252 CarbonylContact O-C 3.5Å; H249-Q252 WeakPolarHBondContact O-CA 3.41Å; H249-Q252 WeakPolarHBondContact O-CB 3.17Å; H249-Q252 PolarHBondContact O-N 3.34Å; H249-Q252 VanDerWaalsContact O-N 3.15Å; R250-Q252 VanDerWaalsContact C-N 3.25Å; R250-Q252 PolarHBondContact O-N 2.82Å; Q252-K256 VanDerWaalsContact O-CB 3.27Å; Q252-K256 WeakPolarHBondContact O-CB 3.33Å; Q252-K256 VanDerWaalsContact O-CD 3.31Å; Q252-K256 WeakPolarHBondContact O-CD 3.22Å; Q252-K256 WeakPolarHBondContact O-CG 3.42Å; Q252-K256 PolarHBondContact O-N 3.39Å
253	H	74.9	Confident	63.9	Low	60 Å²	60	98.2 Å²	98.2	28%	0.278	48%	0.481	S	S	.	.	H	α-helix	trans	-76.7	-48.1	163.2	-84.1	-83.2	0	0	0	109.5	C236 H249 R250 N251 K256 E257	C236-H253 VanDerWaalsContact CB-NE2 3.32Å; C236-H253 WeakPolarHBondContact CB-NE2 3.36Å; H249-H253 AromaticContact CD2-CD2 3.99Å; H249-H253 AromaticContact CE1-CD2 3.7Å; H249-H253 AromaticContact NE2-CD2 3.53Å; H249-H253 PolarHBondContact O-CD2 2.84Å; H249-H253 PolarHBondContact O-N 3.4Å; R250-H253 WeakPolarHBondContact O-CB 3.36Å; R250-H253 PolarHBondContact O-N 3.37Å; R250-H253 VanDerWaalsContact O-N 3.07Å; N251-H253 VanDerWaalsContact C-N 3.32Å; H253-K256 CarbonylContact O-C 3.52Å; H253-K256 WeakPolarHBondContact O-CA 3.11Å; H253-K256 VanDerWaalsContact O-CB 3.32Å; H253-K256 WeakPolarHBondContact O-CB 3.23Å; H253-K256 PolarHBondContact O-N 3.34Å; H253-E257 PolarHBondContact O-N 2.87Å
254	K	68.8	Low	63	Low	114 Å²	114	97 Å²	97	50%	0.496	48%	0.481	S	S	.	.	H	α-helix	trans	-65.8	-41.8	179.9	-157.4	179	-167.8	-56.9	0	113.9	R250 N251 K256 E257 E258	R250-K254 PolarHBondContact O-N 3.47Å; N251-K254 PolarHBondContact O-N 3.25Å; K254-K256 PolarHBondContact O-N 2.86Å; K254-E257 PolarHBondContact O-N 2.89Å; K254-E258 IonicContact NZ-OE1 2.56Å; K254-E258 PolarHBondContact NZ-OE1 2.85Å; K254-E258 WeakPolarHBondContact O-CB 3.37Å; K254-E258 VanDerWaalsContact O-CG 3.3Å; K254-E258 WeakPolarHBondContact O-CG 3.32Å; K254-E258 PolarHBondContact O-N 3.48Å
255	E	63.5	Low	62.5	Low	106 Å²	106	100.9 Å²	100.9	50%	0.495	50%	0.495	S	S	.	.	H	α-helix	trans	-64.5	-23.9	170.4	-72.4	164	-170.2	0	0	111.1	N251 T259	N251-E255 WeakPolarHBondContact O-CB 3.27Å; N251-E255 WeakPolarHBondContact O-CG 3.34Å; N251-E255 PolarHBondContact O-N 2.82Å; E255-T259 WeakPolarHBondContact O-CB 3.17Å; E255-T259 WeakPolarHBondContact O-CG2 3.5Å; E255-T259 PolarHBondContact O-N 3.21Å; E255-T259 PolarHBondContact O-OG1 2.88Å
256	K	64.1	Low	61	Low	130 Å²	130	107.5 Å²	107.5	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-83.2	-32.3	171.6	-84.1	179.6	-178.5	-176.5	0	113.4	Q252 H253 K254 T259 L260	Q252-K256 VanDerWaalsContact O-CB 3.27Å; Q252-K256 WeakPolarHBondContact O-CB 3.33Å; Q252-K256 VanDerWaalsContact O-CD 3.31Å; Q252-K256 WeakPolarHBondContact O-CD 3.22Å; Q252-K256 WeakPolarHBondContact O-CG 3.42Å; Q252-K256 PolarHBondContact O-N 3.39Å; H253-K256 CarbonylContact O-C 3.52Å; H253-K256 WeakPolarHBondContact O-CA 3.11Å; H253-K256 VanDerWaalsContact O-CB 3.32Å; H253-K256 WeakPolarHBondContact O-CB 3.23Å; H253-K256 PolarHBondContact O-N 3.34Å; K254-K256 PolarHBondContact O-N 2.86Å; K256-T259 WeakPolarHBondContact CA-OG1 3.46Å; K256-L260 WeakPolarHBondContact O-CB 3.1Å; K256-L260 WeakPolarHBondContact O-CD1 3.44Å; K256-L260 WeakPolarHBondContact O-CG 3.31Å; K256-L260 PolarHBondContact O-N 3.2Å
257	E	58.6	Low	59.1	Low	105 Å²	105	114 Å²	114	49%	0.491	56%	0.555	S	S	.	*	H	α-helix	trans	-67.2	-51.4	169.6	-70	168.5	141.3	0	0	109	H253 K254 T259 L260 E261	H253-E257 PolarHBondContact O-N 2.87Å; K254-E257 PolarHBondContact O-N 2.89Å; E257-T259 VanDerWaalsContact C-N 3.26Å; E257-T259 PolarHBondContact O-N 3.32Å; E257-L260 CarbonylContact O-C 3.53Å; E257-L260 PolarHBondContact O-N 3.3Å; E257-E261 WeakPolarHBondContact O-CB 3.28Å; E257-E261 WeakPolarHBondContact O-CG 3.42Å; E257-E261 PolarHBondContact O-N 2.9Å
258	E	55.6	Low	57.9	Low	90 Å²	90	118.4 Å²	118.4	42%	0.421	57%	0.573	S	S	.	*	H	α-helix	trans	-62	-27.3	176.2	-69	168.4	-175.8	0	0	113.2	K254 T262	K254-E258 IonicContact NZ-OE1 2.56Å; K254-E258 PolarHBondContact NZ-OE1 2.85Å; K254-E258 WeakPolarHBondContact O-CB 3.37Å; K254-E258 VanDerWaalsContact O-CG 3.3Å; K254-E258 WeakPolarHBondContact O-CG 3.32Å; K254-E258 PolarHBondContact O-N 3.48Å; E258-T262 PolarHBondContact O-N 2.83Å; E258-T262 PolarHBondContact O-OG1 3.45Å
259	T	47.3	Very low	56.5	Low	72 Å²	72	118.9 Å²	118.9	44%	0.442	58%	0.58	S	S	.	*	H	α-helix	trans	-85.8	-31.5	168.9	50.1	0	0	0	0	114.1	E255 K256 E257 E261 T262 T263	E255-T259 WeakPolarHBondContact O-CB 3.17Å; E255-T259 WeakPolarHBondContact O-CG2 3.5Å; E255-T259 PolarHBondContact O-N 3.21Å; E255-T259 PolarHBondContact O-OG1 2.88Å; K256-T259 WeakPolarHBondContact CA-OG1 3.46Å; E257-T259 VanDerWaalsContact C-N 3.26Å; E257-T259 PolarHBondContact O-N 3.32Å; T259-E261 PolarHBondContact O-N 3.14Å; T259-T262 WeakPolarHBondContact CA-OG1 3.33Å; T259-T262 CarbonylContact O-C 3.59Å; T259-T262 PolarHBondContact O-N 3.17Å; T259-T263 PolarHBondContact O-N 2.93Å; T259-T263 PolarHBondContact O-OG1 3.24Å; T259-T263 VanDerWaalsContact O-OG1 3.05Å
260	L	51.6	Low	54.3	Low	103 Å²	103	127.6 Å²	127.6	54%	0.539	61%	0.612	S	S	.	*	H	α-helix	trans	-68.6	-22.6	169.9	-78	164.6	0	0	0	112.5	K256 E257 K264	K256-L260 WeakPolarHBondContact O-CB 3.1Å; K256-L260 WeakPolarHBondContact O-CD1 3.44Å; K256-L260 WeakPolarHBondContact O-CG 3.31Å; K256-L260 PolarHBondContact O-N 3.2Å; E257-L260 CarbonylContact O-C 3.53Å; E257-L260 PolarHBondContact O-N 3.3Å; L260-K264 VanDerWaalsContact O-CB 3.3Å; L260-K264 WeakPolarHBondContact O-CB 3.07Å; L260-K264 WeakPolarHBondContact O-CD 3.48Å; L260-K264 WeakPolarHBondContact O-CG 3.09Å
261	E	49.2	Very low	53	Low	150 Å²	150	126.1 Å²	126.1	70%	0.701	62%	0.624	S	S	*	*	H	α-helix	trans	-81.3	-27.6	170.6	-72.3	176.6	158.7	0	0	112.2	E257 T259	E257-E261 WeakPolarHBondContact O-CB 3.28Å; E257-E261 WeakPolarHBondContact O-CG 3.42Å; E257-E261 PolarHBondContact O-N 2.9Å; T259-E261 PolarHBondContact O-N 3.14Å
262	T	46.5	Very low	51.9	Low	112 Å²	112	126.6 Å²	126.6	69%	0.687	63%	0.632	S	S	*	*	H	α-helix	trans	-100.1	-8	178.6	51.3	0	0	0	0	115.1	E258 T259	E258-T262 PolarHBondContact O-N 2.83Å; E258-T262 PolarHBondContact O-OG1 3.45Å; T259-T262 WeakPolarHBondContact CA-OG1 3.33Å; T259-T262 CarbonylContact O-C 3.59Å; T259-T262 PolarHBondContact O-N 3.17Å
263	T	44.7	Very low	50.8	Low	95 Å²	95	129.2 Å²	129.2	58%	0.583	64%	0.642	S	S	*	*	S	Bend	trans	-119.8	44.6	167.9	75.1	0	0	0	0	111.1	T259	T259-T263 PolarHBondContact O-N 2.93Å; T259-T263 PolarHBondContact O-OG1 3.24Å; T259-T263 VanDerWaalsContact O-OG1 3.05Å
264	K	42.2	Very low	49.7	Very low	170 Å²	170	135.3 Å²	135.3	74%	0.739	66%	0.663	S	S	*	*	S	Bend	trans	-107.3	12.1	171.6	-113.6	-179	-177.8	-174	0	114.2	L260	L260-K264 VanDerWaalsContact O-CB 3.3Å; L260-K264 WeakPolarHBondContact O-CB 3.07Å; L260-K264 WeakPolarHBondContact O-CD 3.48Å; L260-K264 WeakPolarHBondContact O-CG 3.09Å
265	L	47.8	Very low	49.5	Very low	158 Å²	158	133.9 Å²	133.9	83%	0.827	66%	0.655	S	S	*	*	S	Bend	trans	-114.1	150.1	150.3	-72.2	164.6	0	0	0	106.4
266	E	39.6	Very low	49.5	Very low	191 Å²	191	134 Å²	134	89%	0.893	66%	0.656	S	S	*	*	S	Bend	trans	72.8	52.8	-175.9	-56.3	-174.4	-177.4	0	0	116.3
267	D	35.7	Very low	49.7	Very low	160 Å²	160	128.4 Å²	128.4	86%	0.856	63%	0.633	S	S	*	*				83.4	146.4	117.1	-139.5	-7.6	0	0	0	122
268	E	48	Very low	49.7	Very low	182 Å²	182	127.8 Å²	127.8	85%	0.85	65%	0.646	S	S	*	*			trans	-93.1	107	173.8	-72.2	-164.7	97.3	0	0	111.4
269	M	46.9	Very low	49.8	Very low	162 Å²	162	130.7 Å²	130.7	80%	0.798	66%	0.659	S	S	*	*			trans	-149.3	143.9	155.4	-112.9	-155	-176.6	0	0	116.2
270	R	35.4	Very low	50.7	Low	214 Å²	214	129.4 Å²	129.4	81%	0.808	65%	0.652	S	S	*	*			trans	59.1	80.9	162.1	-170.3	157.8	-74.2	149.7	1.2	116.3	P272	R270-P272 WeakPolarHBondContact O-CD 3.41Å
271	A	48.8	Very low	51.3	Low	86 Å²	86	131.9 Å²	131.9	71%	0.711	66%	0.659	S	S	*	*			trans	-57	119.9	162.1	0	0	0	0	0	112.2
272	P	47.4	Very low	52.1	Low	94 Å²	94	132.3 Å²	132.3	61%	0.61	65%	0.654	S	S	*	*			trans	-88.5	131.8	174.9	-6.5	26.4	0	0	0	110.9	R270 R274	R270-P272 WeakPolarHBondContact O-CD 3.41Å; P272-R274 PolarHBondContact O-N 2.96Å
273	F	50.1	Low	52.9	Low	160 Å²	160	131.3 Å²	131.3	70%	0.702	64%	0.644	S	S	*	*			trans	-29.3	110.1	-177.4	-62.6	-87.1	0	0	0	115.9	Y275	F273-Y275 HydrophobicContact CB-CD2 4.46Å; F273-Y275 HydrophobicContact CB-CE1 4.1Å; F273-Y275 HydrophobicContact CB-CE2 3.68Å; F273-Y275 VanDerWaalsContact CB-CZ 3.46Å; F273-Y275 WeakPolarHBondContact CB-OH 3.47Å; F273-Y275 WeakPolarHBondContact O-CD2 3.39Å; F273-Y275 WeakPolarHBondContact O-CE2 3.4Å; F273-Y275 PolarHBondContact O-N 2.75Å
274	R	52.8	Low	54.4	Low	187 Å²	187	128.9 Å²	128.9	71%	0.706	63%	0.625	S	S	*	*			trans	-89	89.3	178	-72.2	-173.1	-162.1	-168.3	9.3	110.2	P272 Q276 I283	P272-R274 PolarHBondContact O-N 2.96Å; R274-Q276 PolarHBondContact O-N 3.14Å; R274-I283 HydrophobicContact CB-CG2 3.52Å; R274-I283 HydrophobicContact CG-CG2 3.81Å
275	Y	64.9	Low	55.1	Low	84 Å²	84	124.7 Å²	124.7	33%	0.329	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.2	114.4	178.8	-55	-77.1	0	0	0	110.5	F273 F284 V287	F273-Y275 HydrophobicContact CB-CD2 4.46Å; F273-Y275 HydrophobicContact CB-CE1 4.1Å; F273-Y275 HydrophobicContact CB-CE2 3.68Å; F273-Y275 VanDerWaalsContact CB-CZ 3.46Å; F273-Y275 WeakPolarHBondContact CB-OH 3.47Å; F273-Y275 WeakPolarHBondContact O-CD2 3.39Å; F273-Y275 WeakPolarHBondContact O-CE2 3.4Å; F273-Y275 PolarHBondContact O-N 2.75Å; Y275-F284 PolarHBondContact N-O 3.43Å; Y275-F284 PolarHBondContact O-N 2.82Å; Y275-V287 HydrophobicContact CD1-CG2 3.77Å; Y275-V287 HydrophobicContact CD2-CG2 3.99Å; Y275-V287 HydrophobicContact CE1-CG2 3.43Å; Y275-V287 VanDerWaalsContact CE1-CG2 3.43Å; Y275-V287 HydrophobicContact CE2-CG2 3.65Å; Y275-V287 HydrophobicContact CG-CG2 4.03Å
276	Q	63.3	Low	55.9	Low	109 Å²	109	121.6 Å²	121.6	51%	0.509	60%	0.599	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.6	133.1	-176.8	-167.2	170	35.5	0	0	111.6	R274 K281 R282 I283	R274-Q276 PolarHBondContact O-N 3.14Å; Q276-K281 WeakPolarHBondContact CG-O 3.34Å; Q276-K281 PolarHBondContact NE2-O 3.35Å; Q276-R282 CarbonylContact C-O 3.42Å; Q276-R282 WeakPolarHBondContact CA-O 3.38Å; Q276-I283 HydrophobicContact CB-CG1 4.13Å; Q276-I283 HydrophobicContact CG-CG1 3.95Å
277	C	67.6	Low	57.1	Low	13 Å²	13	115.5 Å²	115.5	9%	0.088	57%	0.574	C	S	.	*			trans	-73.3	125.4	169	-173.6	0	0	0	0	110	E279 C280 K281 R282 L290	C277-E279 VanDerWaalsContact C-N 3.35Å; C277-E279 PolarHBondContact O-N 3.05Å; C277-C280 PolarHBondContact SG-SG 3.09Å; C277-K281 WeakPolarHBondContact O-CA 3.26Å; C277-K281 PolarHBondContact O-N 3.19Å; C277-R282 PolarHBondContact N-O 3.06Å; C277-L290 HydrophobicContact CB-CD1 3.48Å; C277-L290 VanDerWaalsContact CB-CD1 3.48Å
278	A	58.5	Low	58	Low	92 Å²	92	110.7 Å²	110.7	76%	0.76	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-39.2	-175.2	0	0	0	0	0	113.1
279	E	58.1	Low	58.7	Low	150 Å²	150	106.8 Å²	106.8	70%	0.701	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-37.5	-170.9	-58.9	174	151.6	0	0	113	C277 C295	C277-E279 VanDerWaalsContact C-N 3.35Å; C277-E279 PolarHBondContact O-N 3.05Å; E279-C295 HydrophobicContact CB-CB 4.16Å; E279-C295 WeakPolarHBondContact OE2-CB 3.4Å
280	C	66.6	Low	59.7	Low	45 Å²	45	101.1 Å²	101.1	30%	0.304	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.8	8.7	-169.1	54.3	0	0	0	0	113.6	C277 R282 H293 C295	C277-C280 PolarHBondContact SG-SG 3.09Å; C280-R282 PolarHBondContact O-N 3.06Å; C280-H293 PolarHBondContact SG-NE2 3.15Å; C280-C295 HydrophobicContact CB-CB 3.83Å; C280-C295 WeakPolarHBondContact CB-SG 3.18Å; C280-C295 WeakPolarHBondContact SG-CB 3.33Å; C280-C295 CovalentContact SG-SG 2.03Å; C280-C295 PolarHBondContact SG-SG 2.96Å
281	K	63.5	Low	60.8	Low	155 Å²	155	100.4 Å²	100.4	67%	0.674	50%	0.503	S	S	*	.			trans	56.1	11.1	169.9	-59.4	-173.4	179.9	-176.5	0	116.5	Q276 C277	Q276-K281 WeakPolarHBondContact CG-O 3.34Å; Q276-K281 PolarHBondContact NE2-O 3.35Å; C277-K281 WeakPolarHBondContact O-CA 3.26Å; C277-K281 PolarHBondContact O-N 3.19Å
282	R	66.5	Low	61.3	Low	159 Å²	159	101.6 Å²	101.6	60%	0.6	50%	0.498	S	S	*	.			trans	-69.1	141.8	173.6	-76.9	-176.1	168.9	-175	-0.3	111.4	Q276 C277 C280 F284	Q276-R282 CarbonylContact C-O 3.42Å; Q276-R282 WeakPolarHBondContact CA-O 3.38Å; C277-R282 PolarHBondContact N-O 3.06Å; C280-R282 PolarHBondContact O-N 3.06Å; R282-F284 HydrophobicContact CB-CE2 3.57Å; R282-F284 HydrophobicContact CB-CZ 3.88Å
283	I	63.2	Low	62.3	Low	92 Å²	92	98.8 Å²	98.8	47%	0.472	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	134.7	-175.8	-69.5	171.6	0	0	0	110.2	R274 Q276	R274-I283 HydrophobicContact CB-CG2 3.52Å; R274-I283 HydrophobicContact CG-CG2 3.81Å; Q276-I283 HydrophobicContact CB-CG1 4.13Å; Q276-I283 HydrophobicContact CG-CG1 3.95Å
284	F	74.8	Confident	62.7	Low	43 Å²	43	97.6 Å²	97.6	19%	0.189	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	141.8	-178.9	-60.9	-90.3	0	0	0	110.4	Y275 R282 Q286 K289 L290 H293	Y275-F284 PolarHBondContact N-O 3.43Å; Y275-F284 PolarHBondContact O-N 2.82Å; R282-F284 HydrophobicContact CB-CE2 3.57Å; R282-F284 HydrophobicContact CB-CZ 3.88Å; F284-Q286 VanDerWaalsContact C-N 3.28Å; F284-Q286 PolarHBondContact O-N 3.4Å; F284-K289 HydrophobicContact CB-CB 4.33Å; F284-K289 HydrophobicContact CD1-CB 3.94Å; F284-K289 WeakPolarHBondContact CD1-O 3.29Å; F284-K289 HydrophobicContact CG-CB 4.48Å; F284-L290 HydrophobicContact CB-CB 4.28Å; F284-L290 HydrophobicContact CD2-CB 4.16Å; F284-L290 HydrophobicContact CD2-CD1 3.95Å; F284-L290 HydrophobicContact CE2-CD1 4.22Å; F284-L290 HydrophobicContact CG-CB 4.29Å; F284-H293 HydrophobicContact CE1-CB 4.39Å; F284-H293 HydrophobicContact CE2-CB 4.46Å; F284-H293 AromaticContact CE2-CD2 3.18Å; F284-H293 WeakPolarHBondContact CE2-CD2 3.5Å; F284-H293 AromaticContact CE2-NE2 3.8Å; F284-H293 HydrophobicContact CZ-CB 4.04Å; F284-H293 AromaticContact CZ-CD2 3.06Å; F284-H293 WeakPolarHBondContact CZ-CD2 3.26Å; F284-H293 AromaticContact CZ-CG 3.56Å; F284-H293 AromaticContact CZ-NE2 3.56Å
285	S	57.8	Low	62.9	Low	82 Å²	82	90 Å²	90	57%	0.573	45%	0.452	S	S	*	.	S	Bend	trans	-81.2	-2.6	178.8	51	0	0	0	0	114.4
286	Q	65.3	Low	62.1	Low	94 Å²	94	92.8 Å²	92.8	44%	0.439	47%	0.473	S	S	.	.	S	Bend	trans	-148.9	137.6	-178.4	-64.7	178.3	-51.6	0	0	110.6	F284 S288 K289 L290	F284-Q286 VanDerWaalsContact C-N 3.28Å; F284-Q286 PolarHBondContact O-N 3.4Å; Q286-S288 PolarHBondContact O-N 2.65Å; Q286-K289 HydrophobicContact CB-CD 4.31Å; Q286-K289 HydrophobicContact CB-CG 4.47Å; Q286-K289 PolarHBondContact O-N 3Å; Q286-K289 VanDerWaalsContact O-N 3.09Å; Q286-L290 PolarHBondContact O-N 2.82Å
287	V	63.1	Low	61.4	Low	62 Å²	62	95.3 Å²	95.3	38%	0.376	49%	0.49	S	S	.	.	H	α-helix	trans	-57.4	-35.6	179.3	-175.8	0	0	0	0	112.5	Y275 K289 L290 R291	Y275-V287 HydrophobicContact CD1-CG2 3.77Å; Y275-V287 HydrophobicContact CD2-CG2 3.99Å; Y275-V287 HydrophobicContact CE1-CG2 3.43Å; Y275-V287 VanDerWaalsContact CE1-CG2 3.43Å; Y275-V287 HydrophobicContact CE2-CG2 3.65Å; Y275-V287 HydrophobicContact CG-CG2 4.03Å; V287-K289 PolarHBondContact O-N 3.23Å; V287-L290 PolarHBondContact O-N 3.31Å; V287-R291 WeakPolarHBondContact O-CB 3.06Å; V287-R291 PolarHBondContact O-N 2.7Å
288	S	56.1	Low	60.2	Low	59 Å²	59	98.9 Å²	98.9	41%	0.413	52%	0.521	S	S	.	.	H	α-helix	trans	-57.7	-47.4	175.3	45	0	0	0	0	112	Q286 L290 R291 D292	Q286-S288 PolarHBondContact O-N 2.65Å; S288-L290 VanDerWaalsContact C-N 3.26Å; S288-L290 PolarHBondContact O-N 2.89Å; S288-R291 CarbonylContact O-C 3.59Å; S288-R291 WeakPolarHBondContact O-CA 3.47Å; S288-R291 WeakPolarHBondContact O-CB 3.48Å; S288-R291 PolarHBondContact O-N 2.98Å; S288-D292 VanDerWaalsContact O-CG 3.26Å; S288-D292 PolarHBondContact O-N 3.11Å
289	K	63.2	Low	59.8	Low	100 Å²	100	98.8 Å²	98.8	44%	0.435	52%	0.52	S	S	.	.	H	α-helix	trans	-69	-21.5	179.9	-68	171.6	175.3	154.6	0	113.8	F284 Q286 V287 H293	F284-K289 HydrophobicContact CB-CB 4.33Å; F284-K289 HydrophobicContact CD1-CB 3.94Å; F284-K289 WeakPolarHBondContact CD1-O 3.29Å; F284-K289 HydrophobicContact CG-CB 4.48Å; Q286-K289 HydrophobicContact CB-CD 4.31Å; Q286-K289 HydrophobicContact CB-CG 4.47Å; Q286-K289 PolarHBondContact O-N 3Å; Q286-K289 VanDerWaalsContact O-N 3.09Å; V287-K289 PolarHBondContact O-N 3.23Å; K289-H293 WeakPolarHBondContact O-CB 3.44Å
290	L	66.6	Low	59.6	Low	44 Å²	44	99.9 Å²	99.9	23%	0.23	53%	0.525	C	S	.	.	H	α-helix	trans	-79.3	-37	167.5	175.3	58.8	0	0	0	111.5	C277 F284 Q286 V287 S288 D292 H293	C277-L290 HydrophobicContact CB-CD1 3.48Å; C277-L290 VanDerWaalsContact CB-CD1 3.48Å; F284-L290 HydrophobicContact CB-CB 4.28Å; F284-L290 HydrophobicContact CD2-CB 4.16Å; F284-L290 HydrophobicContact CD2-CD1 3.95Å; F284-L290 HydrophobicContact CE2-CD1 4.22Å; F284-L290 HydrophobicContact CG-CB 4.29Å; Q286-L290 PolarHBondContact O-N 2.82Å; V287-L290 PolarHBondContact O-N 3.31Å; S288-L290 VanDerWaalsContact C-N 3.26Å; S288-L290 PolarHBondContact O-N 2.89Å; L290-D292 VanDerWaalsContact C-N 3.31Å; L290-D292 PolarHBondContact O-N 2.79Å; L290-H293 WeakPolarHBondContact O-CB 3.48Å; L290-H293 PolarHBondContact O-N 2.87Å
291	R	58.6	Low	59.1	Low	199 Å²	199	103 Å²	103	75%	0.751	53%	0.533	S	S	*	.	H	α-helix	trans	-69.5	-28.3	176.4	-162.4	-175.9	-57.1	-177.6	1.9	112.9	V287 S288 H293	V287-R291 WeakPolarHBondContact O-CB 3.06Å; V287-R291 PolarHBondContact O-N 2.7Å; S288-R291 CarbonylContact O-C 3.59Å; S288-R291 WeakPolarHBondContact O-CA 3.47Å; S288-R291 WeakPolarHBondContact O-CB 3.48Å; S288-R291 PolarHBondContact O-N 2.98Å; R291-H293 PolarHBondContact O-N 3.42Å
292	D	58.5	Low	59	Low	111 Å²	111	99.8 Å²	99.8	59%	0.594	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	11.3	172.7	-59.9	-34.8	0	0	0	112.7	S288 L290	S288-D292 VanDerWaalsContact O-CG 3.26Å; S288-D292 PolarHBondContact O-N 3.11Å; L290-D292 VanDerWaalsContact C-N 3.31Å; L290-D292 PolarHBondContact O-N 2.79Å
293	H	69.3	Low	58.7	Low	35 Å²	35	96.8 Å²	96.8	16%	0.162	52%	0.517	C	S	.	.			trans	-122.5	89.3	-173.7	178.1	35.3	0	0	0	113.3	C280 F284 K289 L290 R291 C295	C280-H293 PolarHBondContact SG-NE2 3.15Å; F284-H293 HydrophobicContact CE1-CB 4.39Å; F284-H293 HydrophobicContact CE2-CB 4.46Å; F284-H293 AromaticContact CE2-CD2 3.18Å; F284-H293 WeakPolarHBondContact CE2-CD2 3.5Å; F284-H293 AromaticContact CE2-NE2 3.8Å; F284-H293 HydrophobicContact CZ-CB 4.04Å; F284-H293 AromaticContact CZ-CD2 3.06Å; F284-H293 WeakPolarHBondContact CZ-CD2 3.26Å; F284-H293 AromaticContact CZ-CG 3.56Å; F284-H293 AromaticContact CZ-NE2 3.56Å; K289-H293 WeakPolarHBondContact O-CB 3.44Å; L290-H293 WeakPolarHBondContact O-CB 3.48Å; L290-H293 PolarHBondContact O-N 2.87Å; R291-H293 PolarHBondContact O-N 3.42Å; H293-C295 PolarHBondContact CE1-SG 3.33Å; H293-C295 PolarHBondContact NE2-SG 2.99Å; H293-C295 VanDerWaalsContact NE2-SG 3.35Å
294	D	58.3	Low	58.9	Low	134 Å²	134	98 Å²	98	72%	0.717	52%	0.521	S	S	*	.			trans	-68.8	142.2	166.4	-53.9	-52.7	0	0	0	111.3
295	C	56.9	Low	58.5	Low	27 Å²	27	96 Å²	96	18%	0.182	51%	0.512	C	S	.	.			trans	-118.4	102.5	169.7	-94.5	0	0	0	0	112.3	E279 C280 H293	E279-C295 HydrophobicContact CB-CB 4.16Å; E279-C295 WeakPolarHBondContact OE2-CB 3.4Å; C280-C295 HydrophobicContact CB-CB 3.83Å; C280-C295 WeakPolarHBondContact CB-SG 3.18Å; C280-C295 WeakPolarHBondContact SG-CB 3.33Å; C280-C295 CovalentContact SG-SG 2.03Å; C280-C295 PolarHBondContact SG-SG 2.96Å; H293-C295 PolarHBondContact CE1-SG 3.33Å; H293-C295 PolarHBondContact NE2-SG 2.99Å; H293-C295 VanDerWaalsContact NE2-SG 3.35Å
296	N	48.8	Very low	58.6	Low	143 Å²	143	96.8 Å²	96.8	77%	0.765	51%	0.514	S	S	*	.	S	Bend	trans	68.4	99.9	176	-64.5	-27.1	0	0	0	117.7	A298	N296-A298 PolarHBondContact O-N 3.31Å
297	N	49.1	Very low	58.4	Low	163 Å²	163	97.9 Å²	97.9	87%	0.872	52%	0.522	S	S	*	.			trans	59.3	25.1	136.2	-65.8	-15.3	0	0	0	119.7	A299	N297-A299 PolarHBondContact O-N 3.09Å
298	A	40.7	Very low	58.8	Low	88 Å²	88	97.4 Å²	97.4	73%	0.727	52%	0.521	S	S	*	.			trans	-73.5	113.9	147.1	0	0	0	0	0	108.2	N296 E300	N296-A298 PolarHBondContact O-N 3.31Å; A298-E300 PolarHBondContact O-N 3.26Å; A298-E300 VanDerWaalsContact O-N 3.09Å
299	A	52	Low	58.9	Low	89 Å²	89	105 Å²	105	74%	0.736	54%	0.54	S	S	*	.			trans	-84.6	33	-172.1	0	0	0	0	0	114	N297 K301	N297-A299 PolarHBondContact O-N 3.09Å; A299-K301 PolarHBondContact O-N 3.49Å
300	E	52.3	Low	58.9	Low	174 Å²	174	105.2 Å²	105.2	81%	0.813	54%	0.543	S	S	*	.			trans	-77.6	121.1	173.7	-61.8	-157.3	166.2	0	0	109.7	A298 P302	A298-E300 PolarHBondContact O-N 3.26Å; A298-E300 VanDerWaalsContact O-N 3.09Å; E300-P302 WeakPolarHBondContact O-CD 3.47Å
301	K	56.2	Low	58.9	Low	111 Å²	111	106.9 Å²	106.9	48%	0.483	55%	0.552	S	S	.	*			trans	-113.2	95	-175.8	-51.7	175.2	-152.6	161.6	0	107.8	A299 Y303 D311	A299-K301 PolarHBondContact O-N 3.49Å; K301-Y303 PolarHBondContact O-N 3.49Å; K301-Y303 VanDerWaalsContact O-N 3.13Å; K301-D311 HydrophobicContact CB-CB 3.76Å; K301-D311 HydrophobicContact CD-CB 3.3Å; K301-D311 WeakPolarHBondContact CD-OD2 3.12Å; K301-D311 HydrophobicContact CG-CB 4.21Å; K301-D311 IonicContact NZ-OD2 3.96Å; K301-D311 PolarHBondContact NZ-OD2 3.25Å
302	P	61.5	Low	59.6	Low	86 Å²	86	99.4 Å²	99.4	56%	0.558	53%	0.525	S	S	*	.			trans	-71.3	-17.9	-160.9	-21.6	34.4	0	0	0	114.6	E300	E300-P302 WeakPolarHBondContact O-CD 3.47Å
303	Y	61.2	Low	59.5	Low	96 Å²	96	100.6 Å²	100.6	38%	0.376	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	96.2	-169.8	-49.4	-72.2	0	0	0	111.6	K301 F312 K315 V318	K301-Y303 PolarHBondContact O-N 3.49Å; K301-Y303 VanDerWaalsContact O-N 3.13Å; Y303-F312 PolarHBondContact N-O 3.46Å; Y303-F312 PolarHBondContact O-N 3.35Å; Y303-K315 HydrophobicContact CD1-CB 4.2Å; Y303-K315 HydrophobicContact CD1-CG 4.45Å; Y303-K315 HydrophobicContact CD2-CB 4.35Å; Y303-K315 VanDerWaalsContact CD2-N 3.32Å; Y303-K315 HydrophobicContact CE1-CB 3.96Å; Y303-K315 HydrophobicContact CE1-CD 4.41Å; Y303-K315 HydrophobicContact CE1-CG 4.31Å; Y303-K315 HydrophobicContact CE2-CB 4.09Å; Y303-K315 HydrophobicContact CG-CB 4.38Å; Y303-V318 HydrophobicContact CG-CG2 4.49Å; Y303-V318 WeakPolarHBondContact O-CG2 2.95Å
304	H	67	Low	59.4	Low	118 Å²	118	103.7 Å²	103.7	55%	0.546	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	142.5	172	62.9	-91.5	0	0	0	111.1	T306	H304-T306 PolarHBondContact O-N 2.93Å
305	C	66	Low	59.6	Low	1 Å²	1	104.1 Å²	104.1	1%	0.007	54%	0.536	C	S	.	.			trans	-79.7	115.6	166.1	-178.3	0	0	0	0	109.9	L307 C308 R309 Q310 F312 H321 H325	C305-L307 PolarHBondContact O-N 2.94Å; C305-L307 VanDerWaalsContact O-N 3.12Å; C305-C308 PolarHBondContact O-N 3.41Å; C305-R309 VanDerWaalsContact O-CA 3.28Å; C305-R309 WeakPolarHBondContact O-CA 3.33Å; C305-R309 PolarHBondContact O-N 2.99Å; C305-Q310 PolarHBondContact N-O 2.86Å; C305-F312 HydrophobicContact CB-CE2 4.19Å; C305-H321 VanDerWaalsContact SG-CD2 3.51Å; C305-H325 PolarHBondContact SG-NE2 3.23Å; C305-H325 VanDerWaalsContact SG-NE2 3.43Å
306	T	59.6	Low	60.2	Low	99 Å²	99	108.3 Å²	108.3	61%	0.607	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-24.4	179.3	52.3	0	0	0	0	114.1	H304	H304-T306 PolarHBondContact O-N 2.93Å
307	L	61.6	Low	61.3	Low	117 Å²	117	103.9 Å²	103.9	61%	0.613	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-20.4	-173.5	-60.7	176.5	0	0	0	114.7	C305 H325	C305-L307 PolarHBondContact O-N 2.94Å; C305-L307 VanDerWaalsContact O-N 3.12Å; L307-H325 HydrophobicContact CD1-CB 3.53Å
308	C	70.5	Confident	62.4	Low	52 Å²	52	96.8 Å²	96.8	35%	0.351	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.2	2.4	178.6	71.1	0	0	0	0	115.3	C305 Q310 H321	C305-C308 PolarHBondContact O-N 3.41Å; C308-Q310 PolarHBondContact O-N 3.01Å; C308-H321 PolarHBondContact SG-NE2 2.7Å
309	R	59.2	Low	63.7	Low	218 Å²	218	96 Å²	96	82%	0.823	49%	0.489	S	S	*	.			trans	54.8	31	179.8	-52.5	-177	-176.7	-169.4	-0.3	114	C305	C305-R309 VanDerWaalsContact O-CA 3.28Å; C305-R309 WeakPolarHBondContact O-CA 3.33Å; C305-R309 PolarHBondContact O-N 2.99Å
310	Q	64.1	Low	64.4	Low	105 Å²	105	99.3 Å²	99.3	49%	0.491	49%	0.487	S	S	.	.			trans	-81.5	133	163.6	-73.2	-174.4	-3.9	0	0	109.6	C305 C308 F312 H321	C305-Q310 PolarHBondContact N-O 2.86Å; C308-Q310 PolarHBondContact O-N 3.01Å; Q310-F312 HydrophobicContact CB-CE2 3.54Å; Q310-F312 HydrophobicContact CB-CZ 3.77Å; Q310-F312 WeakPolarHBondContact O-CD2 3.48Å; Q310-F312 VanDerWaalsContact O-CE2 3.24Å; Q310-F312 WeakPolarHBondContact O-CE2 3.08Å; Q310-H321 PolarHBondContact OE1-CE1 2.95Å
311	D	65.8	Low	65.4	Low	78 Å²	78	92.4 Å²	92.4	42%	0.417	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	143.3	179.4	-38	-48.3	0	0	0	111.1	K301	K301-D311 HydrophobicContact CB-CB 3.76Å; K301-D311 HydrophobicContact CD-CB 3.3Å; K301-D311 WeakPolarHBondContact CD-OD2 3.12Å; K301-D311 HydrophobicContact CG-CB 4.21Å; K301-D311 IonicContact NZ-OD2 3.96Å; K301-D311 PolarHBondContact NZ-OD2 3.25Å
312	F	74.1	Confident	65.8	Low	43 Å²	43	91.5 Å²	91.5	19%	0.189	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	143.6	178.8	-58.2	-95	0	0	0	111.2	Y303 C305 Q310 F314 V318 H321	Y303-F312 PolarHBondContact N-O 3.46Å; Y303-F312 PolarHBondContact O-N 3.35Å; C305-F312 HydrophobicContact CB-CE2 4.19Å; Q310-F312 HydrophobicContact CB-CE2 3.54Å; Q310-F312 HydrophobicContact CB-CZ 3.77Å; Q310-F312 WeakPolarHBondContact O-CD2 3.48Å; Q310-F312 VanDerWaalsContact O-CE2 3.24Å; Q310-F312 WeakPolarHBondContact O-CE2 3.08Å; F312-F314 VanDerWaalsContact C-N 3.34Å; F312-V318 HydrophobicContact CB-CG2 3.63Å; F312-V318 HydrophobicContact CD2-CG2 3.63Å; F312-V318 HydrophobicContact CG-CG2 3.87Å; F312-H321 HydrophobicContact CE1-CB 4.24Å; F312-H321 HydrophobicContact CE2-CB 4.23Å; F312-H321 AromaticContact CE2-CD2 3.65Å; F312-H321 AromaticContact CE2-CG 3.77Å; F312-H321 AromaticContact CE2-NE2 3.96Å; F312-H321 HydrophobicContact CZ-CB 3.85Å; F312-H321 AromaticContact CZ-CD2 3.72Å; F312-H321 AromaticContact CZ-CE1 3.73Å; F312-H321 AromaticContact CZ-CG 3.4Å; F312-H321 AromaticContact CZ-ND1 3.42Å; F312-H321 WeakPolarHBondContact CZ-ND1 3.48Å; F312-H321 AromaticContact CZ-NE2 3.93Å
313	Q	56.4	Low	65.9	Low	136 Å²	136	92.9 Å²	92.9	64%	0.636	45%	0.454	S	S	*	.	S	Bend	trans	-71.9	-26.8	178.9	-69.7	163.9	-41.7	0	0	112.8
314	F	66.8	Low	65.7	Low	100 Å²	100	94.9 Å²	94.9	44%	0.439	47%	0.468	S	S	.	.	S	Bend	trans	-126.2	135.7	-173.4	-54.3	-74.8	0	0	0	112.3	F312 V316 S317 V318	F312-F314 VanDerWaalsContact C-N 3.34Å; F314-V316 VanDerWaalsContact C-N 3.26Å; F314-V316 PolarHBondContact O-N 3.5Å; F314-S317 WeakPolarHBondContact O-CA 3.42Å; F314-S317 VanDerWaalsContact O-CB 3.3Å; F314-S317 WeakPolarHBondContact O-CB 3.22Å; F314-S317 PolarHBondContact O-N 2.98Å; F314-V318 PolarHBondContact O-N 2.91Å
315	K	62.6	Low	65.6	Low	142 Å²	142	92 Å²	92	62%	0.617	46%	0.455	S	S	*	.	H	α-helix	trans	-54.4	-40.6	176.5	-170.2	174	-178.8	177.4	0	112.4	Y303 S317 V318 T319	Y303-K315 HydrophobicContact CD1-CB 4.2Å; Y303-K315 HydrophobicContact CD1-CG 4.45Å; Y303-K315 HydrophobicContact CD2-CB 4.35Å; Y303-K315 VanDerWaalsContact CD2-N 3.32Å; Y303-K315 HydrophobicContact CE1-CB 3.96Å; Y303-K315 HydrophobicContact CE1-CD 4.41Å; Y303-K315 HydrophobicContact CE1-CG 4.31Å; Y303-K315 HydrophobicContact CE2-CB 4.09Å; Y303-K315 HydrophobicContact CG-CB 4.38Å; K315-S317 VanDerWaalsContact C-N 3.27Å; K315-S317 PolarHBondContact O-N 3.28Å; K315-V318 PolarHBondContact O-N 2.86Å; K315-V318 VanDerWaalsContact O-N 3.09Å; K315-T319 PolarHBondContact O-N 3.07Å; K315-T319 PolarHBondContact O-OG1 2.87Å; K315-T319 VanDerWaalsContact O-OG1 3.12Å
316	V	68.8	Low	65.3	Low	116 Å²	116	95 Å²	95	70%	0.703	48%	0.476	S	S	*	.	H	α-helix	trans	-60.4	-35.5	176.2	-177.2	0	0	0	0	112	F314 T319 K320	F314-V316 VanDerWaalsContact C-N 3.26Å; F314-V316 PolarHBondContact O-N 3.5Å; V316-T319 PolarHBondContact O-N 3.4Å; V316-K320 VanDerWaalsContact O-CB 3.32Å; V316-K320 WeakPolarHBondContact O-CB 3.17Å; V316-K320 PolarHBondContact O-N 3.22Å
317	S	71.4	Confident	65	Low	50 Å²	50	101.8 Å²	101.8	35%	0.35	49%	0.49	S	S	.	.	H	α-helix	trans	-68.9	-38.9	174.9	-62.7	0	0	0	0	111.6	F314 K315 H321	F314-S317 WeakPolarHBondContact O-CA 3.42Å; F314-S317 VanDerWaalsContact O-CB 3.3Å; F314-S317 WeakPolarHBondContact O-CB 3.22Å; F314-S317 PolarHBondContact O-N 2.98Å; K315-S317 VanDerWaalsContact C-N 3.27Å; K315-S317 PolarHBondContact O-N 3.28Å; S317-H321 WeakPolarHBondContact O-CB 3.4Å; S317-H321 PolarHBondContact O-N 3.21Å
318	V	72.9	Confident	64.7	Low	14 Å²	14	104 Å²	104	9%	0.085	50%	0.497	C	S	.	.	H	α-helix	trans	-64.7	-45.1	171.2	-179.5	0	0	0	0	111.5	Y303 F312 F314 K315 K320 H321 M322	Y303-V318 HydrophobicContact CG-CG2 4.49Å; Y303-V318 WeakPolarHBondContact O-CG2 2.95Å; F312-V318 HydrophobicContact CB-CG2 3.63Å; F312-V318 HydrophobicContact CD2-CG2 3.63Å; F312-V318 HydrophobicContact CG-CG2 3.87Å; F314-V318 PolarHBondContact O-N 2.91Å; K315-V318 PolarHBondContact O-N 2.86Å; K315-V318 VanDerWaalsContact O-N 3.09Å; V318-K320 VanDerWaalsContact C-N 3.34Å; V318-K320 PolarHBondContact O-N 2.97Å; V318-H321 CarbonylContact O-C 3.57Å; V318-H321 WeakPolarHBondContact O-CA 3.49Å; V318-H321 PolarHBondContact O-N 3.02Å; V318-H321 VanDerWaalsContact O-N 3.08Å; V318-M322 HydrophobicContact CG1-CG 4.05Å; V318-M322 HydrophobicContact CG1-SD 3.9Å; V318-M322 WeakPolarHBondContact O-CB 3.39Å; V318-M322 WeakPolarHBondContact O-CG 3.23Å; V318-M322 PolarHBondContact O-N 3.45Å
319	T	67.1	Low	63.7	Low	71 Å²	71	103.9 Å²	103.9	44%	0.436	50%	0.497	S	S	.	.	H	α-helix	trans	-60.1	-44.8	178.2	-50.3	0	0	0	0	111.4	K315 V316 H321 M322 M323	K315-T319 PolarHBondContact O-N 3.07Å; K315-T319 PolarHBondContact O-OG1 2.87Å; K315-T319 VanDerWaalsContact O-OG1 3.12Å; V316-T319 PolarHBondContact O-N 3.4Å; T319-H321 VanDerWaalsContact C-N 3.28Å; T319-H321 PolarHBondContact O-N 2.79Å; T319-M322 PolarHBondContact O-N 3.44Å; T319-M323 PolarHBondContact O-N 2.69Å; T319-M323 VanDerWaalsContact O-N 3.15Å
320	K	68.2	Low	63.8	Low	158 Å²	158	98 Å²	98	69%	0.687	49%	0.485	S	S	*	.	H	α-helix	trans	-65.3	-29.6	175.2	-173.5	175.7	-179.5	178.5	0	113.1	V316 V318	V316-K320 VanDerWaalsContact O-CB 3.32Å; V316-K320 WeakPolarHBondContact O-CB 3.17Å; V316-K320 PolarHBondContact O-N 3.22Å; V318-K320 VanDerWaalsContact C-N 3.34Å; V318-K320 PolarHBondContact O-N 2.97Å
321	H	73	Confident	63.8	Low	30 Å²	30	96.4 Å²	96.4	14%	0.139	48%	0.477	C	S	.	.	H	α-helix	trans	-79.8	-33.5	174.4	176.5	83.9	0	0	0	112.6	C305 C308 Q310 F312 S317 V318 T319 M323 M324 H325	C305-H321 VanDerWaalsContact SG-CD2 3.51Å; C308-H321 PolarHBondContact SG-NE2 2.7Å; Q310-H321 PolarHBondContact OE1-CE1 2.95Å; F312-H321 HydrophobicContact CE1-CB 4.24Å; F312-H321 HydrophobicContact CE2-CB 4.23Å; F312-H321 AromaticContact CE2-CD2 3.65Å; F312-H321 AromaticContact CE2-CG 3.77Å; F312-H321 AromaticContact CE2-NE2 3.96Å; F312-H321 HydrophobicContact CZ-CB 3.85Å; F312-H321 AromaticContact CZ-CD2 3.72Å; F312-H321 AromaticContact CZ-CE1 3.73Å; F312-H321 AromaticContact CZ-CG 3.4Å; F312-H321 AromaticContact CZ-ND1 3.42Å; F312-H321 WeakPolarHBondContact CZ-ND1 3.48Å; F312-H321 AromaticContact CZ-NE2 3.93Å; S317-H321 WeakPolarHBondContact O-CB 3.4Å; S317-H321 PolarHBondContact O-N 3.21Å; V318-H321 CarbonylContact O-C 3.57Å; V318-H321 WeakPolarHBondContact O-CA 3.49Å; V318-H321 PolarHBondContact O-N 3.02Å; V318-H321 VanDerWaalsContact O-N 3.08Å; T319-H321 VanDerWaalsContact C-N 3.28Å; T319-H321 PolarHBondContact O-N 2.79Å; H321-M323 VanDerWaalsContact C-N 3.26Å; H321-M323 PolarHBondContact O-N 3.17Å; H321-M324 WeakPolarHBondContact O-CA 3.23Å; H321-M324 VanDerWaalsContact O-CB 3.24Å; H321-M324 WeakPolarHBondContact O-CB 3.23Å; H321-M324 PolarHBondContact O-N 3.17Å; H321-H325 AromaticContact CD2-CD2 3.81Å; H321-H325 AromaticContact CD2-NE2 3.53Å; H321-H325 AromaticContact CE1-NE2 3.65Å; H321-H325 AromaticContact NE2-CD2 3.69Å; H321-H325 AromaticContact NE2-CE1 4Å; H321-H325 AromaticContact NE2-NE2 2.93Å; H321-H325 PolarHBondContact NE2-NE2 3.26Å; H321-H325 PolarHBondContact O-CD2 2.88Å
322	M	63.1	Low	63.8	Low	91 Å²	91	99.5 Å²	99.5	45%	0.448	49%	0.486	S	S	.	.	H	α-helix	trans	-64.1	-32.2	172.1	-74.4	178	70.7	0	0	111.7	V318 T319 M324 H325 S326	V318-M322 HydrophobicContact CG1-CG 4.05Å; V318-M322 HydrophobicContact CG1-SD 3.9Å; V318-M322 WeakPolarHBondContact O-CB 3.39Å; V318-M322 WeakPolarHBondContact O-CG 3.23Å; V318-M322 PolarHBondContact O-N 3.45Å; T319-M322 PolarHBondContact O-N 3.44Å; M322-M324 PolarHBondContact O-N 2.85Å; M322-M324 VanDerWaalsContact O-N 3.16Å; M322-H325 PolarHBondContact O-N 2.98Å; M322-S326 PolarHBondContact O-N 3.24Å
323	M	64.1	Low	63.8	Low	116 Å²	116	97.5 Å²	97.5	57%	0.571	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-15.1	168.7	-67.5	178.1	-178.9	0	0	114.2	T319 H321 S326	T319-M323 PolarHBondContact O-N 2.69Å; T319-M323 VanDerWaalsContact O-N 3.15Å; H321-M323 VanDerWaalsContact C-N 3.26Å; H321-M323 PolarHBondContact O-N 3.17Å; M323-S326 WeakPolarHBondContact CA-OG 3.17Å; M323-S326 PolarHBondContact O-OG 3.24Å; M323-S326 VanDerWaalsContact O-OG 3.07Å
324	M	58.1	Low	64.4	Low	137 Å²	137	99.9 Å²	99.9	68%	0.675	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-18.4	170.8	-59.6	-70.7	-58.8	0	0	112.8	H321 M322	H321-M324 WeakPolarHBondContact O-CA 3.23Å; H321-M324 VanDerWaalsContact O-CB 3.24Å; H321-M324 WeakPolarHBondContact O-CB 3.23Å; H321-M324 PolarHBondContact O-N 3.17Å; M322-M324 PolarHBondContact O-N 2.85Å; M322-M324 VanDerWaalsContact O-N 3.16Å
325	H	64	Low	64.5	Low	59 Å²	59	100.9 Å²	100.9	27%	0.273	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-28.3	177.5	-68.3	-68.5	0	0	0	112.8	C305 L307 H321 M322 R327	C305-H325 PolarHBondContact SG-NE2 3.23Å; C305-H325 VanDerWaalsContact SG-NE2 3.43Å; L307-H325 HydrophobicContact CD1-CB 3.53Å; H321-H325 AromaticContact CD2-CD2 3.81Å; H321-H325 AromaticContact CD2-NE2 3.53Å; H321-H325 AromaticContact CE1-NE2 3.65Å; H321-H325 AromaticContact NE2-CD2 3.69Å; H321-H325 AromaticContact NE2-CE1 4Å; H321-H325 AromaticContact NE2-NE2 2.93Å; H321-H325 PolarHBondContact NE2-NE2 3.26Å; H321-H325 PolarHBondContact O-CD2 2.88Å; M322-H325 PolarHBondContact O-N 2.98Å; H325-R327 PolarHBondContact O-N 3.3Å
326	S	59.3	Low	65	Low	64 Å²	64	96.5 Å²	96.5	45%	0.448	48%	0.482	S	S	.	.	S	Bend	trans	-63	100	164.2	52.3	0	0	0	0	109.3	M322 M323 E328	M322-S326 PolarHBondContact O-N 3.24Å; M323-S326 WeakPolarHBondContact CA-OG 3.17Å; M323-S326 PolarHBondContact O-OG 3.24Å; M323-S326 VanDerWaalsContact O-OG 3.07Å; S326-E328 PolarHBondContact O-N 3.16Å
327	R	54.9	Low	64.7	Low	241 Å²	241	95.7 Å²	95.7	91%	0.909	48%	0.481	S	S	*	.			trans	-70.9	18.7	-176.2	-70	-175	173.8	-176.1	-1.3	114.6	H325	H325-R327 PolarHBondContact O-N 3.3Å
328	E	55.3	Low	64.7	Low	163 Å²	163	98.3 Å²	98.3	76%	0.762	49%	0.488	S	S	*	.			trans	-107.2	65.1	180	-64.2	-173.6	173.5	0	0	110.7	S326 T330	S326-E328 PolarHBondContact O-N 3.16Å; E328-T330 HydrophobicContact CB-CG2 4.37Å; E328-T330 PolarHBondContact O-N 3.04Å
329	C	48.1	Very low	64.4	Low	50 Å²	50	101.7 Å²	101.7	34%	0.338	51%	0.509	S	S	.	.			trans	-73.3	78.2	168.3	-72.2	0	0	0	0	110	F331	C329-F331 VanDerWaalsContact C-N 3.29Å; C329-F331 PolarHBondContact O-N 3.39Å
330	T	61.2	Low	64.8	Low	95 Å²	95	99.8 Å²	99.8	58%	0.583	50%	0.495	S	S	*	.			trans	-69.7	-15.5	-169.3	44.5	0	0	0	0	115.1	E328 K332	E328-T330 HydrophobicContact CB-CG2 4.37Å; E328-T330 PolarHBondContact O-N 3.04Å; T330-K332 PolarHBondContact O-N 3.3Å; T330-K332 VanDerWaalsContact O-N 3.14Å
331	F	63.9	Low	64.6	Low	70 Å²	70	95.9 Å²	95.9	31%	0.307	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	79.5	-174.1	-53.6	-63.5	0	0	0	112.6	C329 F340 I343 L346	C329-F331 VanDerWaalsContact C-N 3.29Å; C329-F331 PolarHBondContact O-N 3.39Å; F331-F340 PolarHBondContact O-N 2.9Å; F331-I343 HydrophobicContact CD1-CD1 4.29Å; F331-I343 HydrophobicContact CD1-CG1 3.51Å; F331-I343 HydrophobicContact CD2-CG1 4.01Å; F331-I343 HydrophobicContact CE1-CD1 3.64Å; F331-I343 HydrophobicContact CE1-CG1 3.32Å; F331-I343 HydrophobicContact CE2-CD1 4.46Å; F331-I343 HydrophobicContact CE2-CG1 3.83Å; F331-I343 HydrophobicContact CG-CG1 3.86Å; F331-I343 HydrophobicContact CZ-CD1 3.74Å; F331-I343 HydrophobicContact CZ-CG1 3.5Å; F331-I343 VanDerWaalsContact CZ-CG1 3.5Å; F331-L346 HydrophobicContact CB-CB 4.3Å; F331-L346 HydrophobicContact CB-CD2 3.9Å
332	K	66.8	Low	64.2	Low	143 Å²	143	98.2 Å²	98.2	62%	0.622	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	134	170	-68.2	173.5	-178	175.7	0	110.8	T330 Q338 T339	T330-K332 PolarHBondContact O-N 3.3Å; T330-K332 VanDerWaalsContact O-N 3.14Å; K332-Q338 WeakPolarHBondContact CA-O 3.33Å; K332-T339 HydrophobicContact CG-CG2 3.64Å
333	C	74.8	Confident	64.4	Low	2 Å²	2	97.3 Å²	97.3	1%	0.014	50%	0.495	C	S	.	.			trans	-73.6	127.2	164.6	-175.2	0	0	0	0	110.2	E335 S337 Q338 F340 L346 H349 H353	C333-E335 VanDerWaalsContact C-N 3.31Å; C333-E335 PolarHBondContact O-N 3.09Å; C333-S337 WeakPolarHBondContact O-CA 3.36Å; C333-S337 PolarHBondContact O-N 3.02Å; C333-Q338 PolarHBondContact N-O 2.76Å; C333-F340 HydrophobicContact CB-CE2 4.13Å; C333-L346 HydrophobicContact CB-CD1 3.58Å; C333-H349 WeakPolarHBondContact CB-NE2 3.46Å; C333-H349 VanDerWaalsContact SG-CD2 3.52Å; C333-H349 PolarHBondContact SG-NE2 2.88Å; C333-H349 VanDerWaalsContact SG-NE2 3.44Å; C333-H353 PolarHBondContact SG-NE2 3.47Å
334	Q	67.4	Low	64.7	Low	185 Å²	185	98.1 Å²	98.1	86%	0.864	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-28.5	178.3	-68.5	177.4	-17.8	0	0	112.7
335	E	69.3	Low	65.2	Low	121 Å²	121	94.1 Å²	94.1	57%	0.565	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-24	-174.1	-63.4	168.2	-97.3	0	0	114.1	C333 H353	C333-E335 VanDerWaalsContact C-N 3.31Å; C333-E335 PolarHBondContact O-N 3.09Å; E335-H353 VanDerWaalsContact CD-CD2 3.47Å; E335-H353 IonicContact OE1-CD2 3.59Å; E335-H353 PolarHBondContact OE1-CD2 3.41Å; E335-H353 IonicContact OE1-CG 2.7Å; E335-H353 WeakPolarHBondContact OE2-CB 3.48Å; E335-H353 IonicContact OE2-CD2 3.44Å; E335-H353 IonicContact OE2-CG 3.51Å
336	C	73.7	Confident	65.7	Low	50 Å²	50	92.2 Å²	92.2	34%	0.338	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147	20.2	177.2	85.9	0	0	0	0	115.1	Q338 H349	C336-Q338 PolarHBondContact O-N 2.94Å; C336-Q338 PolarHBondContact SG-NE2 2.79Å; C336-H349 PolarHBondContact SG-CE1 3.3Å; C336-H349 PolarHBondContact SG-NE2 3.25Å
337	S	62.7	Low	66.1	Low	99 Å²	99	96.5 Å²	96.5	69%	0.692	48%	0.483	S	S	*	.			trans	59.2	3.6	172.8	-53.2	0	0	0	0	117.6	C333 T339	C333-S337 WeakPolarHBondContact O-CA 3.36Å; C333-S337 PolarHBondContact O-N 3.02Å; S337-T339 PolarHBondContact O-N 3.46Å
338	Q	70	Confident	66.6	Low	106 Å²	106	91.4 Å²	91.4	50%	0.495	47%	0.467	S	S	.	.			trans	-66.3	130.7	178.8	-76.5	-178.2	60.1	0	0	111	K332 C333 C336 F340	K332-Q338 WeakPolarHBondContact CA-O 3.33Å; C333-Q338 PolarHBondContact N-O 2.76Å; C336-Q338 PolarHBondContact O-N 2.94Å; C336-Q338 PolarHBondContact SG-NE2 2.79Å; Q338-F340 HydrophobicContact CB-CD2 4.49Å; Q338-F340 HydrophobicContact CB-CE2 3.52Å; Q338-F340 HydrophobicContact CB-CZ 3.72Å; Q338-F340 VanDerWaalsContact O-CD2 3.32Å; Q338-F340 WeakPolarHBondContact O-CD2 3.23Å; Q338-F340 VanDerWaalsContact O-CE2 3.3Å; Q338-F340 WeakPolarHBondContact O-CE2 3.3Å
339	T	67.1	Low	67.4	Low	84 Å²	84	84.5 Å²	84.5	52%	0.515	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	130.6	174.5	36.6	0	0	0	0	111	K332 S337	K332-T339 HydrophobicContact CG-CG2 3.64Å; S337-T339 PolarHBondContact O-N 3.46Å
340	F	75.1	Confident	68.4	Low	32 Å²	32	85.5 Å²	85.5	14%	0.14	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	142.6	176.2	-64.3	-84.4	0	0	0	110.8	F331 C333 Q338 N342 L346 H349	F331-F340 PolarHBondContact O-N 2.9Å; C333-F340 HydrophobicContact CB-CE2 4.13Å; Q338-F340 HydrophobicContact CB-CD2 4.49Å; Q338-F340 HydrophobicContact CB-CE2 3.52Å; Q338-F340 HydrophobicContact CB-CZ 3.72Å; Q338-F340 VanDerWaalsContact O-CD2 3.32Å; Q338-F340 WeakPolarHBondContact O-CD2 3.23Å; Q338-F340 VanDerWaalsContact O-CE2 3.3Å; Q338-F340 WeakPolarHBondContact O-CE2 3.3Å; F340-N342 PolarHBondContact O-N 2.85Å; F340-L346 HydrophobicContact CB-CB 4.26Å; F340-L346 HydrophobicContact CD2-CB 4.22Å; F340-L346 HydrophobicContact CD2-CD1 4.03Å; F340-L346 HydrophobicContact CE2-CD1 4.39Å; F340-L346 HydrophobicContact CG-CB 4.39Å; F340-H349 HydrophobicContact CE1-CB 4.05Å; F340-H349 HydrophobicContact CE2-CB 4.05Å; F340-H349 AromaticContact CE2-CD2 3.19Å; F340-H349 WeakPolarHBondContact CE2-CD2 3Å; F340-H349 AromaticContact CE2-CG 3.6Å; F340-H349 AromaticContact CE2-NE2 3.63Å; F340-H349 HydrophobicContact CZ-CB 3.68Å; F340-H349 AromaticContact CZ-CD2 3.38Å; F340-H349 WeakPolarHBondContact CZ-CD2 3.44Å; F340-H349 AromaticContact CZ-CE1 3.85Å; F340-H349 AromaticContact CZ-CG 3.28Å; F340-H349 AromaticContact CZ-ND1 3.61Å; F340-H349 AromaticContact CZ-NE2 3.73Å
341	P	64.1	Low	68.8	Low	76 Å²	76	88.7 Å²	88.7	49%	0.494	44%	0.44	S	S	.	.	S	Bend	trans	-77.6	3.3	177.6	32.4	-36.7	0	0	0	113.4
342	N	66.2	Low	68.6	Low	79 Å²	79	87.6 Å²	87.6	42%	0.422	44%	0.442	S	S	.	.	S	Bend	trans	-158.8	137.8	-176.2	-169.3	-39.3	0	0	0	111.6	F340 M344 S345 L346	F340-N342 PolarHBondContact O-N 2.85Å; N342-M344 PolarHBondContact O-N 3.5Å; N342-M344 WeakPolarHBondContact OD1-CB 3.24Å; N342-M344 PolarHBondContact OD1-N 3Å; N342-S345 WeakPolarHBondContact O-CB 3.28Å; N342-S345 PolarHBondContact O-N 3.26Å; N342-L346 PolarHBondContact O-N 3.36Å
343	I	67.4	Low	68.7	Low	72 Å²	72	83.3 Å²	83.3	37%	0.369	42%	0.424	S	S	.	.	H	α-helix	trans	-52.6	-39.1	172.5	-63.9	173.2	0	0	0	112.1	F331 S345 L346 R347	F331-I343 HydrophobicContact CD1-CD1 4.29Å; F331-I343 HydrophobicContact CD1-CG1 3.51Å; F331-I343 HydrophobicContact CD2-CG1 4.01Å; F331-I343 HydrophobicContact CE1-CD1 3.64Å; F331-I343 HydrophobicContact CE1-CG1 3.32Å; F331-I343 HydrophobicContact CE2-CD1 4.46Å; F331-I343 HydrophobicContact CE2-CG1 3.83Å; F331-I343 HydrophobicContact CG-CG1 3.86Å; F331-I343 HydrophobicContact CZ-CD1 3.74Å; F331-I343 HydrophobicContact CZ-CG1 3.5Å; F331-I343 VanDerWaalsContact CZ-CG1 3.5Å; I343-S345 VanDerWaalsContact C-N 3.34Å; I343-S345 PolarHBondContact O-N 2.92Å; I343-L346 PolarHBondContact O-N 3.2Å; I343-R347 HydrophobicContact CG2-CG 4.25Å; I343-R347 WeakPolarHBondContact O-CB 3.44Å; I343-R347 WeakPolarHBondContact O-CG 3.24Å; I343-R347 PolarHBondContact O-N 3.46Å
344	M	69.4	Low	67.9	Low	132 Å²	132	86.1 Å²	86.1	65%	0.65	45%	0.447	S	S	*	.	H	α-helix	trans	-65.3	-37.8	178.7	-69.2	-68.9	-81.9	0	0	111.9	N342 F348	N342-M344 PolarHBondContact O-N 3.5Å; N342-M344 WeakPolarHBondContact OD1-CB 3.24Å; N342-M344 PolarHBondContact OD1-N 3Å; M344-F348 WeakPolarHBondContact O-CB 3.46Å; M344-F348 PolarHBondContact O-N 3.35Å
345	S	68.6	Low	67.4	Low	54 Å²	54	81.8 Å²	81.8	38%	0.378	44%	0.443	S	S	.	.	H	α-helix	trans	-68.5	-41.7	173.7	-57	0	0	0	0	111.3	N342 I343 F348 H349	N342-S345 WeakPolarHBondContact O-CB 3.28Å; N342-S345 PolarHBondContact O-N 3.26Å; I343-S345 VanDerWaalsContact C-N 3.34Å; I343-S345 PolarHBondContact O-N 2.92Å; S345-F348 PolarHBondContact O-N 3.48Å; S345-H349 WeakPolarHBondContact O-CB 3.42Å; S345-H349 PolarHBondContact O-N 3.35Å
346	L	75.6	Confident	66.7	Low	19 Å²	19	83.4 Å²	83.4	10%	0.099	45%	0.454	C	S	.	.	H	α-helix	trans	-60.8	-47.7	173.3	172.2	58.1	0	0	0	111.4	F331 C333 F340 N342 I343 F348 H349 Q350	F331-L346 HydrophobicContact CB-CB 4.3Å; F331-L346 HydrophobicContact CB-CD2 3.9Å; C333-L346 HydrophobicContact CB-CD1 3.58Å; F340-L346 HydrophobicContact CB-CB 4.26Å; F340-L346 HydrophobicContact CD2-CB 4.22Å; F340-L346 HydrophobicContact CD2-CD1 4.03Å; F340-L346 HydrophobicContact CE2-CD1 4.39Å; F340-L346 HydrophobicContact CG-CB 4.39Å; N342-L346 PolarHBondContact O-N 3.36Å; I343-L346 PolarHBondContact O-N 3.2Å; L346-F348 VanDerWaalsContact C-N 3.34Å; L346-F348 PolarHBondContact O-N 3.39Å; L346-H349 CarbonylContact O-C 3.5Å; L346-H349 WeakPolarHBondContact O-CA 3.45Å; L346-H349 WeakPolarHBondContact O-CB 3.44Å; L346-H349 PolarHBondContact O-N 3.07Å; L346-H349 VanDerWaalsContact O-N 3.07Å; L346-Q350 HydrophobicContact CD1-CG 3.95Å; L346-Q350 HydrophobicContact CG-CG 4.41Å; L346-Q350 WeakPolarHBondContact O-CG 3.46Å; L346-Q350 PolarHBondContact O-N 2.03Å
347	R	66	Low	65.9	Low	153 Å²	153	86.6 Å²	86.6	58%	0.577	46%	0.463	S	S	*	.	H	α-helix	trans	-61.9	-38.2	177.3	-75.7	178	174.7	177.2	-2.2	112.4	I343 H349 K351	I343-R347 HydrophobicContact CG2-CG 4.25Å; I343-R347 WeakPolarHBondContact O-CB 3.44Å; I343-R347 WeakPolarHBondContact O-CG 3.24Å; I343-R347 PolarHBondContact O-N 3.46Å; R347-H349 VanDerWaalsContact C-N 3.32Å; R347-K351 WeakPolarHBondContact O-CG 3.36Å; R347-K351 PolarHBondContact O-N 3.46Å
348	F	66.3	Low	66	Low	134 Å²	134	86 Å²	86	59%	0.588	46%	0.456	S	S	*	.	H	α-helix	trans	-66.5	-35.5	173.5	-173.2	-94.7	0	0	0	112	M344 S345 L346 S352	M344-F348 WeakPolarHBondContact O-CB 3.46Å; M344-F348 PolarHBondContact O-N 3.35Å; S345-F348 PolarHBondContact O-N 3.48Å; L346-F348 VanDerWaalsContact C-N 3.34Å; L346-F348 PolarHBondContact O-N 3.39Å; F348-S352 PolarHBondContact O-N 3.18Å
349	H	73	Confident	65.8	Low	19 Å²	19	85.2 Å²	85.2	9%	0.088	45%	0.45	C	S	.	.	H	α-helix	trans	-73.7	-36.9	175.4	169.6	73.2	0	0	0	113.4	C333 C336 F340 S345 L346 R347 K351 S352 H353	C333-H349 WeakPolarHBondContact CB-NE2 3.46Å; C333-H349 VanDerWaalsContact SG-CD2 3.52Å; C333-H349 PolarHBondContact SG-NE2 2.88Å; C333-H349 VanDerWaalsContact SG-NE2 3.44Å; C336-H349 PolarHBondContact SG-CE1 3.3Å; C336-H349 PolarHBondContact SG-NE2 3.25Å; F340-H349 HydrophobicContact CE1-CB 4.05Å; F340-H349 HydrophobicContact CE2-CB 4.05Å; F340-H349 AromaticContact CE2-CD2 3.19Å; F340-H349 WeakPolarHBondContact CE2-CD2 3Å; F340-H349 AromaticContact CE2-CG 3.6Å; F340-H349 AromaticContact CE2-NE2 3.63Å; F340-H349 HydrophobicContact CZ-CB 3.68Å; F340-H349 AromaticContact CZ-CD2 3.38Å; F340-H349 WeakPolarHBondContact CZ-CD2 3.44Å; F340-H349 AromaticContact CZ-CE1 3.85Å; F340-H349 AromaticContact CZ-CG 3.28Å; F340-H349 AromaticContact CZ-ND1 3.61Å; F340-H349 AromaticContact CZ-NE2 3.73Å; S345-H349 WeakPolarHBondContact O-CB 3.42Å; S345-H349 PolarHBondContact O-N 3.35Å; L346-H349 CarbonylContact O-C 3.5Å; L346-H349 WeakPolarHBondContact O-CA 3.45Å; L346-H349 WeakPolarHBondContact O-CB 3.44Å; L346-H349 PolarHBondContact O-N 3.07Å; L346-H349 VanDerWaalsContact O-N 3.07Å; R347-H349 VanDerWaalsContact C-N 3.32Å; H349-K351 VanDerWaalsContact C-N 3.35Å; H349-S352 VanDerWaalsContact O-CA 3.29Å; H349-S352 WeakPolarHBondContact O-CA 3.48Å; H349-S352 WeakPolarHBondContact O-CB 3.41Å; H349-S352 PolarHBondContact O-N 3Å; H349-S352 PolarHBondContact O-OG 3.43Å; H349-H353 AromaticContact CD2-NE2 3.68Å; H349-H353 AromaticContact CE1-CE1 3.56Å; H349-H353 AromaticContact CE1-NE2 3.44Å; H349-H353 PolarHBondContact CE1-NE2 2.82Å; H349-H353 AromaticContact NE2-CE1 3.64Å; H349-H353 AromaticContact NE2-NE2 3.07Å; H349-H353 PolarHBondContact NE2-NE2 3.19Å; H349-H353 PolarHBondContact O-N 3.12Å
350	Q	69	Low	65.8	Low	70 Å²	70	87.2 Å²	87.2	33%	0.327	45%	0.453	S	S	.	.	H	α-helix	trans	-63.2	-40.9	170.7	-72.2	170.9	-54.8	0	0	111.1	L346 S352 H353 A354	L346-Q350 HydrophobicContact CD1-CG 3.95Å; L346-Q350 HydrophobicContact CG-CG 4.41Å; L346-Q350 WeakPolarHBondContact O-CG 3.46Å; L346-Q350 PolarHBondContact O-N 2.03Å; Q350-S352 PolarHBondContact O-N 3.25Å; Q350-H353 PolarHBondContact O-N 3.24Å; Q350-A354 PolarHBondContact O-N 3.21Å; Q350-A354 VanDerWaalsContact O-N 3.11Å
351	K	68.9	Low	66	Low	162 Å²	162	85.7 Å²	85.7	70%	0.704	45%	0.446	S	S	*	.	H	α-helix	trans	-61.2	-7.9	166.8	-72	179.3	179	-171.6	0	114	R347 H349	R347-K351 WeakPolarHBondContact O-CG 3.36Å; R347-K351 PolarHBondContact O-N 3.46Å; H349-K351 VanDerWaalsContact C-N 3.35Å
352	S	60.5	Low	66.4	Low	47 Å²	47	87.3 Å²	87.3	33%	0.329	46%	0.457	S	S	.	.	H	α-helix	trans	-92.7	-23.6	172.7	92.8	0	0	0	0	113.6	F348 H349 Q350 K369	F348-S352 PolarHBondContact O-N 3.18Å; H349-S352 VanDerWaalsContact O-CA 3.29Å; H349-S352 WeakPolarHBondContact O-CA 3.48Å; H349-S352 WeakPolarHBondContact O-CB 3.41Å; H349-S352 PolarHBondContact O-N 3Å; H349-S352 PolarHBondContact O-OG 3.43Å; Q350-S352 PolarHBondContact O-N 3.25Å; S352-K369 PolarHBondContact O-NZ 3.43Å
353	H	66.9	Low	66.6	Low	54 Å²	54	87.9 Å²	87.9	25%	0.25	46%	0.457	C	S	.	.	H	α-helix	trans	-81.1	-33.2	170.6	-59.3	-47.3	0	0	0	112.5	C333 E335 H349 Q350 A355	C333-H353 PolarHBondContact SG-NE2 3.47Å; E335-H353 VanDerWaalsContact CD-CD2 3.47Å; E335-H353 IonicContact OE1-CD2 3.59Å; E335-H353 PolarHBondContact OE1-CD2 3.41Å; E335-H353 IonicContact OE1-CG 2.7Å; E335-H353 WeakPolarHBondContact OE2-CB 3.48Å; E335-H353 IonicContact OE2-CD2 3.44Å; E335-H353 IonicContact OE2-CG 3.51Å; H349-H353 AromaticContact CD2-NE2 3.68Å; H349-H353 AromaticContact CE1-CE1 3.56Å; H349-H353 AromaticContact CE1-NE2 3.44Å; H349-H353 PolarHBondContact CE1-NE2 2.82Å; H349-H353 AromaticContact NE2-CE1 3.64Å; H349-H353 AromaticContact NE2-NE2 3.07Å; H349-H353 PolarHBondContact NE2-NE2 3.19Å; H349-H353 PolarHBondContact O-N 3.12Å; Q350-H353 PolarHBondContact O-N 3.24Å; H353-A355 VanDerWaalsContact C-N 3.33Å; H353-A355 PolarHBondContact O-N 3.36Å
354	A	58.8	Low	66.9	Low	61 Å²	61	87 Å²	87	50%	0.504	46%	0.456	S	S	.	.	S	Bend	trans	-57	92.1	169.9	0	0	0	0	0	110.7	Q350 L356	Q350-A354 PolarHBondContact O-N 3.21Å; Q350-A354 VanDerWaalsContact O-N 3.11Å; A354-L356 PolarHBondContact O-N 2.82Å
355	A	56.3	Low	66.8	Low	93 Å²	93	83.2 Å²	83.2	77%	0.769	45%	0.452	S	S	*	.			trans	-81.4	17.2	-164.5	0	0	0	0	0	114.8	H353	H353-A355 VanDerWaalsContact C-N 3.33Å; H353-A355 PolarHBondContact O-N 3.36Å
356	L	55.9	Low	66.9	Low	155 Å²	155	85.3 Å²	85.3	81%	0.812	46%	0.457	S	S	*	.			trans	-81.9	114.4	167.3	-61.3	-179.8	0	0	0	108.7	A354 P358	A354-L356 PolarHBondContact O-N 2.82Å; L356-P358 VanDerWaalsContact O-CD 3.23Å; L356-P358 WeakPolarHBondContact O-CD 3.24Å
357	K	56.1	Low	66.5	Low	118 Å²	118	85.4 Å²	85.4	51%	0.513	46%	0.46	S	S	.	.			trans	-90.5	100.4	173.4	-64.1	172.7	176.8	-176.7	0	108	Y359 A367	K357-Y359 VanDerWaalsContact C-N 3.25Å; K357-Y359 PolarHBondContact O-N 2.87Å; K357-A367 HydrophobicContact CB-CB 3.81Å; K357-A367 HydrophobicContact CD-CB 3.5Å; K357-A367 VanDerWaalsContact CD-CB 3.5Å; K357-A367 HydrophobicContact CG-CB 4.38Å
358	P	64.6	Low	66.9	Low	86 Å²	86	79.7 Å²	79.7	56%	0.558	44%	0.44	S	S	*	.			trans	-80.7	-3.7	-163.1	-12.6	30.4	0	0	0	114.4	L356	L356-P358 VanDerWaalsContact O-CD 3.23Å; L356-P358 WeakPolarHBondContact O-CD 3.24Å
359	Y	65.8	Low	66.8	Low	90 Å²	90	78.9 Å²	78.9	35%	0.353	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	92.5	-167.7	-54.2	-72.2	0	0	0	110.6	K357 F368 H370 Y371	K357-Y359 VanDerWaalsContact C-N 3.25Å; K357-Y359 PolarHBondContact O-N 2.87Å; Y359-F368 PolarHBondContact O-N 3.15Å; Y359-H370 VanDerWaalsContact CD2-C 3.45Å; Y359-Y371 AromaticContact CD1-CD2 3.87Å; Y359-Y371 HydrophobicContact CD1-CD2 3.87Å; Y359-Y371 HydrophobicContact CD1-CG 4.34Å; Y359-Y371 HydrophobicContact CE1-CD2 4.18Å; Y359-Y371 HydrophobicContact CE1-CG 4.41Å
360	E	66.9	Low	66.6	Low	125 Å²	125	82.1 Å²	82.1	58%	0.584	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	137.9	173.8	-49.4	-155.1	136.9	0	0	110.3	P362 M366 A367	E360-P362 WeakPolarHBondContact O-CD 3.4Å; E360-M366 WeakPolarHBondContact CA-O 3.34Å; E360-A367 HydrophobicContact CG-CB 3.84Å; E360-A367 WeakPolarHBondContact OE1-CB 3.35Å
361	C	79.4	Confident	66.3	Low	1 Å²	1	84.7 Å²	84.7	1%	0.007	46%	0.459	C	S	.	.			trans	-76.4	119.9	174.1	179.4	0	0	0	0	110	E363 C364 G365 M366 F368 M374	C361-E363 PolarHBondContact O-N 2.82Å; C361-E363 VanDerWaalsContact O-N 3.12Å; C361-C364 VanDerWaalsContact CB-SG 3.55Å; C361-C364 PolarHBondContact O-N 3.37Å; C361-C364 VanDerWaalsContact SG-SG 3.68Å; C361-G365 PolarHBondContact O-N 3.4Å; C361-M366 PolarHBondContact N-O 3.15Å; C361-F368 HydrophobicContact CB-CE2 4.16Å; C361-M374 HydrophobicContact CB-CG 4.17Å; C361-M374 HydrophobicContact CB-SD 4.22Å
362	P	73	Confident	66.1	Low	110 Å²	110	80.7 Å²	80.7	71%	0.714	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-26.8	-177.9	-25.5	35.4	0	0	0	114.1	E360	E360-P362 WeakPolarHBondContact O-CD 3.4Å
363	E	70.6	Confident	66.5	Low	91 Å²	91	82 Å²	82	43%	0.425	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-8.4	-173.4	-60.7	178.4	-112.2	0	0	113.8	C361 R378 H381	C361-E363 PolarHBondContact O-N 2.82Å; C361-E363 VanDerWaalsContact O-N 3.12Å; E363-R378 WeakPolarHBondContact OE1-CG 3.43Å; E363-H381 WeakPolarHBondContact OE2-CB 3.39Å; E363-H381 IonicContact OE2-CG 3.87Å
364	C	73.8	Confident	67.3	Low	52 Å²	52	80 Å²	80	35%	0.351	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.2	-1.9	-175.2	70.3	0	0	0	0	116.6	C361 M366 H377 H381	C361-C364 VanDerWaalsContact CB-SG 3.55Å; C361-C364 PolarHBondContact O-N 3.37Å; C361-C364 VanDerWaalsContact SG-SG 3.68Å; C364-M366 PolarHBondContact O-N 2.83Å; C364-H377 PolarHBondContact SG-NE2 3Å; C364-H381 WeakPolarHBondContact CB-NE2 3.43Å
365	G	67.2	Low	68.1	Low	54 Å²	54	78.5 Å²	78.5	56%	0.557	43%	0.43	S	S	*	.			trans	67.1	13	-178.6	0	0	0	0	0	114.8	C361 A367	C361-G365 PolarHBondContact O-N 3.4Å; G365-A367 PolarHBondContact O-N 3.31Å
366	M	70.1	Confident	68.8	Low	97 Å²	97	77.6 Å²	77.6	48%	0.478	41%	0.413	S	S	.	.			trans	-75.5	116.2	175.1	-74.6	-163.8	65.5	0	0	110.8	E360 C361 C364 F368 H377	E360-M366 WeakPolarHBondContact CA-O 3.34Å; C361-M366 PolarHBondContact N-O 3.15Å; C364-M366 PolarHBondContact O-N 2.83Å; M366-F368 HydrophobicContact CB-CD2 4.46Å; M366-F368 HydrophobicContact CB-CE2 3.53Å; M366-F368 HydrophobicContact CB-CZ 3.67Å; M366-F368 HydrophobicContact CE-CE1 4.28Å; M366-F368 HydrophobicContact CE-CZ 4Å; M366-F368 WeakPolarHBondContact O-CD2 3.33Å; M366-F368 WeakPolarHBondContact O-CE2 3.42Å; M366-F368 HydrophobicContact SD-CZ 4.36Å; M366-H377 VanDerWaalsContact SD-CE1 3.56Å
367	A	67.7	Low	69.8	Low	22 Å²	22	72 Å²	72	18%	0.182	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	127.8	176.4	0	0	0	0	0	112.9	K357 E360 G365	K357-A367 HydrophobicContact CB-CB 3.81Å; K357-A367 HydrophobicContact CD-CB 3.5Å; K357-A367 VanDerWaalsContact CD-CB 3.5Å; K357-A367 HydrophobicContact CG-CB 4.38Å; E360-A367 HydrophobicContact CG-CB 3.84Å; E360-A367 WeakPolarHBondContact OE1-CB 3.35Å; G365-A367 PolarHBondContact O-N 3.31Å
368	F	73.9	Confident	70.8	Confident	33 Å²	33	70.9 Å²	70.9	15%	0.145	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	160.3	-176.7	-60.6	-86.7	0	0	0	112.6	Y359 C361 M366 V373 M374 H377	Y359-F368 PolarHBondContact O-N 3.15Å; C361-F368 HydrophobicContact CB-CE2 4.16Å; M366-F368 HydrophobicContact CB-CD2 4.46Å; M366-F368 HydrophobicContact CB-CE2 3.53Å; M366-F368 HydrophobicContact CB-CZ 3.67Å; M366-F368 HydrophobicContact CE-CE1 4.28Å; M366-F368 HydrophobicContact CE-CZ 4Å; M366-F368 WeakPolarHBondContact O-CD2 3.33Å; M366-F368 WeakPolarHBondContact O-CE2 3.42Å; M366-F368 HydrophobicContact SD-CZ 4.36Å; F368-V373 HydrophobicContact CD1-CG1 3.86Å; F368-V373 HydrophobicContact CE1-CG1 4.48Å; F368-M374 HydrophobicContact CB-CB 4.11Å; F368-M374 HydrophobicContact CD2-CB 3.71Å; F368-M374 HydrophobicContact CD2-CG 3.78Å; F368-M374 HydrophobicContact CE2-CG 4.37Å; F368-M374 HydrophobicContact CG-CB 4.16Å; F368-H377 HydrophobicContact CE1-CB 4.26Å; F368-H377 HydrophobicContact CE2-CB 3.92Å; F368-H377 AromaticContact CE2-CD2 3.74Å; F368-H377 AromaticContact CE2-CG 3.77Å; F368-H377 HydrophobicContact CZ-CB 3.62Å; F368-H377 AromaticContact CZ-CD2 3.7Å; F368-H377 AromaticContact CZ-CE1 3.97Å; F368-H377 AromaticContact CZ-CG 3.36Å; F368-H377 AromaticContact CZ-ND1 3.56Å
369	K	63.5	Low	71.2	Confident	116 Å²	116	73 Å²	73	50%	0.504	37%	0.371	S	S	.	.	S	Bend	trans	-80.8	-17.5	-180	-64.5	-158.1	174.4	-158.2	0	114.6	S352	S352-K369 PolarHBondContact O-NZ 3.43Å
370	H	68.9	Low	71	Confident	87 Å²	87	72.1 Å²	72.1	40%	0.403	37%	0.37	S	S	.	.	S	Bend	trans	-143.3	141.3	-178.6	-62.3	-62.5	0	0	0	111.3	Y359 S372 V373 M374	Y359-H370 VanDerWaalsContact CD2-C 3.45Å; H370-S372 VanDerWaalsContact C-N 3.34Å; H370-S372 PolarHBondContact O-N 3.44Å; H370-V373 HydrophobicContact CB-CG2 4.19Å; H370-V373 PolarHBondContact O-N 2.78Å; H370-M374 PolarHBondContact O-N 2.96Å; H370-M374 VanDerWaalsContact O-N 3.09Å
371	Y	63.4	Low	71.2	Confident	125 Å²	125	70.2 Å²	70.2	49%	0.49	36%	0.36	S	S	.	.	H	α-helix	trans	-52.8	-47.9	177.7	-179.4	-100.6	0	0	0	112.3	Y359 V373 M374 E375	Y359-Y371 AromaticContact CD1-CD2 3.87Å; Y359-Y371 HydrophobicContact CD1-CD2 3.87Å; Y359-Y371 HydrophobicContact CD1-CG 4.34Å; Y359-Y371 HydrophobicContact CE1-CD2 4.18Å; Y359-Y371 HydrophobicContact CE1-CG 4.41Å; Y371-V373 PolarHBondContact O-N 3.11Å; Y371-M374 HydrophobicContact CD2-CE 3.83Å; Y371-M374 HydrophobicContact CE2-CE 3.68Å; Y371-M374 CarbonylContact O-C 3.59Å; Y371-M374 WeakPolarHBondContact O-CA 3.41Å; Y371-M374 WeakPolarHBondContact O-CB 3.29Å; Y371-M374 PolarHBondContact O-N 3.44Å; Y371-E375 HydrophobicContact CE1-CB 4.22Å; Y371-E375 HydrophobicContact CE1-CG 4.44Å; Y371-E375 WeakPolarHBondContact O-CB 3.49Å; Y371-E375 PolarHBondContact O-N 3.05Å
372	S	64.4	Low	70.5	Confident	77 Å²	77	74.8 Å²	74.8	54%	0.538	39%	0.388	S	S	.	.	H	α-helix	trans	-62.8	-25	-179.8	39.5	0	0	0	0	114.2	H370 D376	H370-S372 VanDerWaalsContact C-N 3.34Å; H370-S372 PolarHBondContact O-N 3.44Å; S372-D376 VanDerWaalsContact O-CB 3.26Å; S372-D376 WeakPolarHBondContact O-CB 3.35Å; S372-D376 PolarHBondContact O-N 2.86Å
373	V	69.8	Low	69.6	Low	74 Å²	74	73.7 Å²	73.7	45%	0.448	38%	0.376	S	S	.	.	H	α-helix	trans	-83	-33	174	-177.3	0	0	0	0	111.5	F368 H370 Y371 H377	F368-V373 HydrophobicContact CD1-CG1 3.86Å; F368-V373 HydrophobicContact CE1-CG1 4.48Å; H370-V373 HydrophobicContact CB-CG2 4.19Å; H370-V373 PolarHBondContact O-N 2.78Å; Y371-V373 PolarHBondContact O-N 3.11Å; V373-H377 WeakPolarHBondContact O-CB 3.44Å; V373-H377 PolarHBondContact O-N 3.34Å; V373-H377 VanDerWaalsContact O-N 3.14Å
374	M	82.6	Confident	68.7	Low	13 Å²	13	74.8 Å²	74.8	6%	0.064	39%	0.385	C	S	.	.	H	α-helix	trans	-65.6	-45.4	168.9	-172.8	-76.3	-70	0	0	110.5	C361 F368 H370 Y371 H377 R378	C361-M374 HydrophobicContact CB-CG 4.17Å; C361-M374 HydrophobicContact CB-SD 4.22Å; F368-M374 HydrophobicContact CB-CB 4.11Å; F368-M374 HydrophobicContact CD2-CB 3.71Å; F368-M374 HydrophobicContact CD2-CG 3.78Å; F368-M374 HydrophobicContact CE2-CG 4.37Å; F368-M374 HydrophobicContact CG-CB 4.16Å; H370-M374 PolarHBondContact O-N 2.96Å; H370-M374 VanDerWaalsContact O-N 3.09Å; Y371-M374 HydrophobicContact CD2-CE 3.83Å; Y371-M374 HydrophobicContact CE2-CE 3.68Å; Y371-M374 CarbonylContact O-C 3.59Å; Y371-M374 WeakPolarHBondContact O-CA 3.41Å; Y371-M374 WeakPolarHBondContact O-CB 3.29Å; Y371-M374 PolarHBondContact O-N 3.44Å; M374-H377 CarbonylContact O-C 3.48Å; M374-H377 WeakPolarHBondContact O-CA 3.39Å; M374-H377 VanDerWaalsContact O-CB 3.28Å; M374-H377 WeakPolarHBondContact O-CB 3.33Å; M374-H377 PolarHBondContact O-N 3.01Å; M374-R378 PolarHBondContact O-N 3.4Å; M374-R378 HydrophobicContact SD-CB 4.26Å
375	E	76.4	Confident	67.7	Low	30 Å²	30	77 Å²	77	14%	0.14	40%	0.401	C	S	.	.	H	α-helix	trans	-68.2	-40.5	179.7	-174.1	58.2	-159.3	0	0	112	Y371 H377 R378 R379	Y371-E375 HydrophobicContact CE1-CB 4.22Å; Y371-E375 HydrophobicContact CE1-CG 4.44Å; Y371-E375 WeakPolarHBondContact O-CB 3.49Å; Y371-E375 PolarHBondContact O-N 3.05Å; E375-H377 PolarHBondContact O-N 3.05Å; E375-R378 PolarHBondContact O-N 3.39Å; E375-R378 IonicContact OE1-CZ 3.55Å; E375-R378 IonicContact OE1-NE 3.53Å; E375-R378 IonicContact OE1-NH2 2.76Å; E375-R378 PolarHBondContact OE1-NH2 3.18Å; E375-R378 IonicContact OE2-CZ 3.39Å; E375-R378 IonicContact OE2-NE 2.74Å; E375-R378 PolarHBondContact OE2-NE 3.3Å; E375-R378 IonicContact OE2-NH2 3.19Å; E375-R378 PolarHBondContact OE2-NH2 2.91Å; E375-R379 WeakPolarHBondContact O-CB 3.43Å; E375-R379 WeakPolarHBondContact O-CG 3.28Å; E375-R379 PolarHBondContact O-N 3.42Å
376	D	69.8	Low	67.2	Low	74 Å²	74	83.5 Å²	83.5	40%	0.396	41%	0.409	S	S	.	.	H	α-helix	trans	-61.5	-24.5	168.1	-88.9	3.9	0	0	0	112.6	S372 R379 K380	S372-D376 VanDerWaalsContact O-CB 3.26Å; S372-D376 WeakPolarHBondContact O-CB 3.35Å; S372-D376 PolarHBondContact O-N 2.86Å; D376-R379 IonicContact OD1-CZ 3.1Å; D376-R379 IonicContact OD1-NE 3.55Å; D376-R379 IonicContact OD1-NH2 2.72Å; D376-R379 PolarHBondContact OD1-NH2 2.84Å; D376-K380 WeakPolarHBondContact O-CG 3.23Å; D376-K380 PolarHBondContact O-NZ 3.08Å
377	H	77.1	Confident	66.9	Low	38 Å²	38	82 Å²	82	18%	0.176	41%	0.408	C	S	.	.	H	α-helix	trans	-82.6	-42	172.4	178.7	92.4	0	0	0	111.9	C364 M366 F368 V373 M374 E375 R379 K380 H381	C364-H377 PolarHBondContact SG-NE2 3Å; M366-H377 VanDerWaalsContact SD-CE1 3.56Å; F368-H377 HydrophobicContact CE1-CB 4.26Å; F368-H377 HydrophobicContact CE2-CB 3.92Å; F368-H377 AromaticContact CE2-CD2 3.74Å; F368-H377 AromaticContact CE2-CG 3.77Å; F368-H377 HydrophobicContact CZ-CB 3.62Å; F368-H377 AromaticContact CZ-CD2 3.7Å; F368-H377 AromaticContact CZ-CE1 3.97Å; F368-H377 AromaticContact CZ-CG 3.36Å; F368-H377 AromaticContact CZ-ND1 3.56Å; V373-H377 WeakPolarHBondContact O-CB 3.44Å; V373-H377 PolarHBondContact O-N 3.34Å; V373-H377 VanDerWaalsContact O-N 3.14Å; M374-H377 CarbonylContact O-C 3.48Å; M374-H377 WeakPolarHBondContact O-CA 3.39Å; M374-H377 VanDerWaalsContact O-CB 3.28Å; M374-H377 WeakPolarHBondContact O-CB 3.33Å; M374-H377 PolarHBondContact O-N 3.01Å; E375-H377 PolarHBondContact O-N 3.05Å; H377-R379 PolarHBondContact O-N 3.01Å; H377-K380 WeakPolarHBondContact O-CA 3.37Å; H377-K380 VanDerWaalsContact O-CB 3.31Å; H377-K380 WeakPolarHBondContact O-CB 3.24Å; H377-K380 PolarHBondContact O-N 2.66Å; H377-H381 PolarHBondContact O-CD2 3.33Å
378	R	77.5	Confident	66.9	Low	94 Å²	94	84.6 Å²	84.6	36%	0.355	42%	0.416	S	S	.	.	H	α-helix	trans	-56.8	-47.1	174.8	-158.4	175.8	68.5	99.2	1.5	111.3	E363 M374 E375 K380 H381 V382	E363-R378 WeakPolarHBondContact OE1-CG 3.43Å; M374-R378 PolarHBondContact O-N 3.4Å; M374-R378 HydrophobicContact SD-CB 4.26Å; E375-R378 PolarHBondContact O-N 3.39Å; E375-R378 IonicContact OE1-CZ 3.55Å; E375-R378 IonicContact OE1-NE 3.53Å; E375-R378 IonicContact OE1-NH2 2.76Å; E375-R378 PolarHBondContact OE1-NH2 3.18Å; E375-R378 IonicContact OE2-CZ 3.39Å; E375-R378 IonicContact OE2-NE 2.74Å; E375-R378 PolarHBondContact OE2-NE 3.3Å; E375-R378 IonicContact OE2-NH2 3.19Å; E375-R378 PolarHBondContact OE2-NH2 2.91Å; R378-K380 PolarHBondContact O-N 2.99Å; R378-K380 VanDerWaalsContact O-N 3.09Å; R378-H381 WeakPolarHBondContact O-CB 3.46Å; R378-H381 PolarHBondContact O-N 3.28Å; R378-V382 PolarHBondContact O-N 3.38Å
379	R	73.6	Confident	66.5	Low	130 Å²	130	87.5 Å²	87.5	49%	0.491	43%	0.432	S	S	.	.	H	α-helix	trans	-56.5	-26.6	172.4	-69.5	-168.2	-74.6	-162	0.7	113.7	E375 D376 H377 H381 V382 D383	E375-R379 WeakPolarHBondContact O-CB 3.43Å; E375-R379 WeakPolarHBondContact O-CG 3.28Å; E375-R379 PolarHBondContact O-N 3.42Å; D376-R379 IonicContact OD1-CZ 3.1Å; D376-R379 IonicContact OD1-NE 3.55Å; D376-R379 IonicContact OD1-NH2 2.72Å; D376-R379 PolarHBondContact OD1-NH2 2.84Å; H377-R379 PolarHBondContact O-N 3.01Å; R379-H381 VanDerWaalsContact C-N 3.32Å; R379-H381 PolarHBondContact O-N 3.28Å; R379-V382 PolarHBondContact O-N 2.86Å; R379-D383 WeakPolarHBondContact O-CB 3.43Å; R379-D383 PolarHBondContact O-N 3.2Å
380	K	61.6	Low	66.9	Low	72 Å²	72	82 Å²	82	31%	0.313	41%	0.408	S	S	.	.	H	α-helix	trans	-78.9	-7.5	175.3	-64.5	171.2	-178.6	80	0	114.6	D376 H377 R378 K398 Y399	D376-K380 WeakPolarHBondContact O-CG 3.23Å; D376-K380 PolarHBondContact O-NZ 3.08Å; H377-K380 WeakPolarHBondContact O-CA 3.37Å; H377-K380 VanDerWaalsContact O-CB 3.31Å; H377-K380 WeakPolarHBondContact O-CB 3.24Å; H377-K380 PolarHBondContact O-N 2.66Å; R378-K380 PolarHBondContact O-N 2.99Å; R378-K380 VanDerWaalsContact O-N 3.09Å; K380-K398 PolarHBondContact O-NZ 3.49Å; K380-Y399 HydrophobicContact CD-CE1 3.91Å; K380-Y399 HydrophobicContact CG-CE1 4.28Å
381	H	70.7	Confident	67	Low	84 Å²	84	85.1 Å²	85.1	39%	0.389	43%	0.428	S	S	.	.	H	α-helix	trans	-83.6	-49.2	163.3	-65.3	-89.2	0	0	0	109.9	E363 C364 H377 R378 R379 N384	E363-H381 WeakPolarHBondContact OE2-CB 3.39Å; E363-H381 IonicContact OE2-CG 3.87Å; C364-H381 WeakPolarHBondContact CB-NE2 3.43Å; H377-H381 PolarHBondContact O-CD2 3.33Å; R378-H381 WeakPolarHBondContact O-CB 3.46Å; R378-H381 PolarHBondContact O-N 3.28Å; R379-H381 VanDerWaalsContact C-N 3.32Å; R379-H381 PolarHBondContact O-N 3.28Å; H381-N384 WeakPolarHBondContact O-CB 3.3Å; H381-N384 PolarHBondContact O-N 3.03Å
382	V	64.4	Low	67.1	Low	97 Å²	97	83.3 Å²	83.3	59%	0.588	43%	0.426	S	S	*	.	H	α-helix	trans	-60.1	-47.1	177.7	-173.9	0	0	0	0	112.6	R378 R379 N384	R378-V382 PolarHBondContact O-N 3.38Å; R379-V382 PolarHBondContact O-N 2.86Å; V382-N384 PolarHBondContact O-N 2.91Å; V382-N384 VanDerWaalsContact O-N 3.12Å
383	D	55	Low	67.1	Low	88 Å²	88	82 Å²	82	47%	0.471	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-74.2	6.5	179.2	-81.9	-43.1	0	0	0	114.3	R379 S385 R386	R379-D383 WeakPolarHBondContact O-CB 3.43Å; R379-D383 PolarHBondContact O-N 3.2Å; D383-S385 PolarHBondContact O-N 3.46Å; D383-R386 PolarHBondContact O-N 3.4Å
384	N	51.4	Low	67.1	Low	113 Å²	113	81.1 Å²	81.1	60%	0.604	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-67.2	-0.5	179.8	-156.3	66.9	0	0	0	113.6	H381 V382 K398	H381-N384 WeakPolarHBondContact O-CB 3.3Å; H381-N384 PolarHBondContact O-N 3.03Å; V382-N384 PolarHBondContact O-N 2.91Å; V382-N384 VanDerWaalsContact O-N 3.12Å; N384-K398 PolarHBondContact OD1-NZ 3.13Å
385	S	53.7	Low	66.5	Low	100 Å²	100	86 Å²	86	70%	0.699	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-93.3	-12.2	173.2	56.5	0	0	0	0	114.9	D383	D383-S385 PolarHBondContact O-N 3.46Å
386	R	55.5	Low	65.7	Low	190 Å²	190	88.7 Å²	88.7	72%	0.717	46%	0.462	S	S	*	.			trans	-119	77.6	-177.4	-76.3	-176.8	172.1	144.7	-2.1	113	D383	D383-R386 PolarHBondContact O-N 3.4Å
387	S	64.8	Low	65.6	Low	64 Å²	64	87.1 Å²	87.1	45%	0.448	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-71.9	128.5	171.4	62.6	0	0	0	0	112.2	L389 T396	S387-L389 PolarHBondContact O-N 2.86Å; S387-T396 WeakPolarHBondContact OG-CG2 3.32Å
388	H	66.6	Low	65.1	Low	78 Å²	78	90.1 Å²	90.1	36%	0.361	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	116.7	176.2	-65	-79.4	0	0	0	110.9	T396 F397 Y399 S400 L403	H388-T396 CarbonylContact O-C 3.51Å; H388-F397 PolarHBondContact N-O 2.9Å; H388-F397 PolarHBondContact O-N 3.43Å; H388-Y399 VanDerWaalsContact CD2-C 3.49Å; H388-S400 PolarHBondContact CD2-N 3.45Å; H388-S400 PolarHBondContact NE2-N 2.85Å; H388-L403 HydrophobicContact CB-CB 4.06Å; H388-L403 HydrophobicContact CB-CD2 3.77Å
389	L	66	Low	64.4	Low	93 Å²	93	90.2 Å²	90.2	49%	0.487	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	141	-178.4	-77	162.6	0	0	0	112.3	S387 T396 L403	S387-L389 PolarHBondContact O-N 2.86Å; L389-T396 HydrophobicContact CD2-CG2 3.46Å; L389-T396 VanDerWaalsContact CD2-CG2 3.46Å; L389-T396 HydrophobicContact CG-CG2 4.24Å; L389-L403 VanDerWaalsContact O-CD2 3.29Å; L389-L403 WeakPolarHBondContact O-CD2 3.34Å
390	C	72.5	Confident	64	Low	0 Å²	0	86.7 Å²	86.7	0%	0	46%	0.461	C	S	.	.			trans	-92.2	104.2	170	-176	0	0	0	0	111.3	I392 C393 G394 K395 F397 L403	C390-I392 PolarHBondContact O-N 2.88Å; C390-C393 PolarHBondContact O-N 3.27Å; C390-G394 PolarHBondContact O-N 3.44Å; C390-K395 PolarHBondContact N-O 3.02Å; C390-F397 HydrophobicContact CB-CE2 4.01Å; C390-L403 VanDerWaalsContact CA-CD1 3.48Å; C390-L403 HydrophobicContact CB-CD1 3.49Å; C390-L403 VanDerWaalsContact CB-CD1 3.49Å
391	N	69.4	Low	64.1	Low	153 Å²	153	87 Å²	87	82%	0.818	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-27.6	-178	-57.9	8.6	0	0	0	113.8
392	I	67.4	Low	64	Low	88 Å²	88	86.2 Å²	86.2	45%	0.451	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-22.2	-179	-57.6	171	0	0	0	112.8	F221 C390 H410	F221-I392 HydrophobicContact CE1-CD1 4.5Å; F221-I392 HydrophobicContact CZ-CD1 4.3Å; C390-I392 PolarHBondContact O-N 2.88Å; I392-H410 HydrophobicContact CD1-CB 3.73Å; I392-H410 HydrophobicContact CG2-CB 4.04Å
393	C	64.3	Low	64.6	Low	49 Å²	49	82.4 Å²	82.4	33%	0.331	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.6	10	-173.2	72.3	0	0	0	0	116.9	C390 K395 H406 H410	C390-C393 PolarHBondContact O-N 3.27Å; C393-K395 PolarHBondContact O-N 3.3Å; C393-K395 VanDerWaalsContact O-N 3.11Å; C393-H406 PolarHBondContact SG-NE2 2.94Å; C393-H410 PolarHBondContact SG-NE2 2.95Å; C393-H410 VanDerWaalsContact SG-NE2 3.39Å
394	G	69.8	Low	65	Low	55 Å²	55	84 Å²	84	57%	0.567	45%	0.451	S	S	*	.			trans	69	2.2	176.4	0	0	0	0	0	116.2	C390	C390-G394 PolarHBondContact O-N 3.44Å
395	K	69.6	Low	65.5	Low	115 Å²	115	81.9 Å²	81.9	50%	0.5	44%	0.437	S	S	.	.			trans	-73.8	131.8	-177.4	-70.7	176.4	-174.1	168.5	0	111.9	C390 C393 F397	C390-K395 PolarHBondContact N-O 3.02Å; C393-K395 PolarHBondContact O-N 3.3Å; C393-K395 VanDerWaalsContact O-N 3.11Å; K395-F397 HydrophobicContact CB-CE2 3.52Å; K395-F397 HydrophobicContact CB-CZ 3.74Å; K395-F397 HydrophobicContact CD-CZ 4.39Å; K395-F397 WeakPolarHBondContact O-CD2 3.49Å; K395-F397 WeakPolarHBondContact O-CE2 3.38Å
396	T	59	Low	66.3	Low	88 Å²	88	78.2 Å²	78.2	54%	0.54	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	135.1	174.2	44.7	0	0	0	0	111.5	S387 H388 L389	S387-T396 WeakPolarHBondContact OG-CG2 3.32Å; H388-T396 CarbonylContact O-C 3.51Å; L389-T396 HydrophobicContact CD2-CG2 3.46Å; L389-T396 VanDerWaalsContact CD2-CG2 3.46Å; L389-T396 HydrophobicContact CG-CG2 4.24Å
397	F	68.1	Low	67	Low	41 Å²	41	71.8 Å²	71.8	18%	0.18	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	137.6	176.3	-63.7	-84.5	0	0	0	110.7	H388 C390 K395 Y399 L402 L403 H406	H388-F397 PolarHBondContact N-O 2.9Å; H388-F397 PolarHBondContact O-N 3.43Å; C390-F397 HydrophobicContact CB-CE2 4.01Å; K395-F397 HydrophobicContact CB-CE2 3.52Å; K395-F397 HydrophobicContact CB-CZ 3.74Å; K395-F397 HydrophobicContact CD-CZ 4.39Å; K395-F397 WeakPolarHBondContact O-CD2 3.49Å; K395-F397 WeakPolarHBondContact O-CE2 3.38Å; F397-Y399 PolarHBondContact O-N 2.94Å; F397-L402 HydrophobicContact CB-CB 4.13Å; F397-L402 HydrophobicContact CD1-CB 4.02Å; F397-L402 HydrophobicContact CG-CB 4.38Å; F397-L403 HydrophobicContact CB-CB 4.25Å; F397-L403 HydrophobicContact CD2-CB 4.23Å; F397-L403 HydrophobicContact CD2-CD1 4.02Å; F397-L403 HydrophobicContact CE2-CD1 4.41Å; F397-L403 HydrophobicContact CG-CB 4.43Å; F397-H406 HydrophobicContact CE1-CB 3.9Å; F397-H406 AromaticContact CE1-CG 3.95Å; F397-H406 HydrophobicContact CE2-CB 3.9Å; F397-H406 AromaticContact CE2-CD2 3.3Å; F397-H406 WeakPolarHBondContact CE2-CD2 3.3Å; F397-H406 AromaticContact CE2-CG 3.66Å; F397-H406 HydrophobicContact CZ-CB 3.54Å; F397-H406 AromaticContact CZ-CD2 3.23Å; F397-H406 WeakPolarHBondContact CZ-CD2 3.24Å; F397-H406 AromaticContact CZ-CG 3.19Å; F397-H406 AromaticContact CZ-ND1 3.84Å; F397-H406 AromaticContact CZ-NE2 3.9Å
398	K	65.5	Low	67.1	Low	101 Å²	101	73.3 Å²	73.3	44%	0.439	38%	0.383	S	S	.	.	S	Bend	trans	-70.2	-15.7	179.1	-176.3	156.9	179.9	150.8	0	113.5	K380 N384	K380-K398 PolarHBondContact O-NZ 3.49Å; N384-K398 PolarHBondContact OD1-NZ 3.13Å
399	Y	64.6	Low	67	Low	96 Å²	96	74 Å²	74	38%	0.376	39%	0.39	S	S	.	.	S	Bend	trans	-135.1	141.8	177.9	-50.4	-53.3	0	0	0	111.2	K380 H388 F397 S401 L402 L403	K380-Y399 HydrophobicContact CD-CE1 3.91Å; K380-Y399 HydrophobicContact CG-CE1 4.28Å; H388-Y399 VanDerWaalsContact CD2-C 3.49Å; F397-Y399 PolarHBondContact O-N 2.94Å; Y399-S401 PolarHBondContact O-N 3.12Å; Y399-L402 HydrophobicContact CD2-CD1 3.62Å; Y399-L402 HydrophobicContact CD2-CG 4.1Å; Y399-L402 HydrophobicContact CE2-CD1 4.34Å; Y399-L402 HydrophobicContact CG-CD1 4.43Å; Y399-L402 WeakPolarHBondContact O-CB 3.22Å; Y399-L402 PolarHBondContact O-N 3.37Å; Y399-L402 VanDerWaalsContact O-N 3.09Å; Y399-L403 PolarHBondContact O-N 3.31Å
400	S	63.9	Low	67	Low	56 Å²	56	72.9 Å²	72.9	39%	0.392	38%	0.382	S	S	.	.	H	α-helix	trans	-59.8	-30.9	173.2	57.6	0	0	0	0	112.5	H388 L403 H404	H388-S400 PolarHBondContact CD2-N 3.45Å; H388-S400 PolarHBondContact NE2-N 2.85Å; S400-L403 PolarHBondContact O-N 2.95Å; S400-H404 PolarHBondContact O-N 3.44Å; S400-H404 PolarHBondContact O-ND1 2.95Å
401	S	64.5	Low	66.5	Low	78 Å²	78	76 Å²	76	55%	0.545	40%	0.401	S	S	.	.	H	α-helix	trans	-66.1	-38.5	173.6	53.8	0	0	0	0	112.8	Y399 Q405	Y399-S401 PolarHBondContact O-N 3.12Å; S401-Q405 VanDerWaalsContact O-CB 3.28Å; S401-Q405 WeakPolarHBondContact O-CB 3.36Å; S401-Q405 PolarHBondContact O-N 3.31Å
402	L	69	Low	66.1	Low	68 Å²	68	71.2 Å²	71.2	36%	0.356	39%	0.388	S	S	.	.	H	α-helix	trans	-69.2	-35.8	171.9	-74.3	175.6	0	0	0	111.7	F397 Y399 H406	F397-L402 HydrophobicContact CB-CB 4.13Å; F397-L402 HydrophobicContact CD1-CB 4.02Å; F397-L402 HydrophobicContact CG-CB 4.38Å; Y399-L402 HydrophobicContact CD2-CD1 3.62Å; Y399-L402 HydrophobicContact CD2-CG 4.1Å; Y399-L402 HydrophobicContact CE2-CD1 4.34Å; Y399-L402 HydrophobicContact CG-CD1 4.43Å; Y399-L402 WeakPolarHBondContact O-CB 3.22Å; Y399-L402 PolarHBondContact O-N 3.37Å; Y399-L402 VanDerWaalsContact O-N 3.09Å; L402-H406 VanDerWaalsContact O-CB 3.24Å; L402-H406 WeakPolarHBondContact O-CB 3.37Å; L402-H406 PolarHBondContact O-N 3Å
403	L	75.8	Confident	65.5	Low	17 Å²	17	70.7 Å²	70.7	9%	0.089	38%	0.383	C	S	.	.	H	α-helix	trans	-62	-51.3	172.5	171	59.4	0	0	0	111.1	H388 L389 C390 F397 Y399 S400 Q405 H406 Q407	H388-L403 HydrophobicContact CB-CB 4.06Å; H388-L403 HydrophobicContact CB-CD2 3.77Å; L389-L403 VanDerWaalsContact O-CD2 3.29Å; L389-L403 WeakPolarHBondContact O-CD2 3.34Å; C390-L403 VanDerWaalsContact CA-CD1 3.48Å; C390-L403 HydrophobicContact CB-CD1 3.49Å; C390-L403 VanDerWaalsContact CB-CD1 3.49Å; F397-L403 HydrophobicContact CB-CB 4.25Å; F397-L403 HydrophobicContact CD2-CB 4.23Å; F397-L403 HydrophobicContact CD2-CD1 4.02Å; F397-L403 HydrophobicContact CE2-CD1 4.41Å; F397-L403 HydrophobicContact CG-CB 4.43Å; Y399-L403 PolarHBondContact O-N 3.31Å; S400-L403 PolarHBondContact O-N 2.95Å; L403-Q405 VanDerWaalsContact C-N 3.35Å; L403-Q405 PolarHBondContact O-N 3.35Å; L403-H406 CarbonylContact O-C 3.54Å; L403-H406 WeakPolarHBondContact O-CA 3.42Å; L403-H406 WeakPolarHBondContact O-CB 3.42Å; L403-H406 PolarHBondContact O-N 3.32Å; L403-Q407 HydrophobicContact CD1-CG 3.89Å; L403-Q407 HydrophobicContact CG-CG 4.37Å; L403-Q407 WeakPolarHBondContact O-CG 3.3Å; L403-Q407 PolarHBondContact O-N 3.26Å; L403-Q407 PolarHBondContact O-OE1 3.29Å
404	H	63.1	Low	65.6	Low	122 Å²	122	74.2 Å²	74.2	57%	0.565	39%	0.393	S	S	*	.	H	α-helix	trans	-61.1	-42.9	177.5	-71.8	100.3	0	0	0	111.9	S400 H406 Q407 Y408	S400-H404 PolarHBondContact O-N 3.44Å; S400-H404 PolarHBondContact O-ND1 2.95Å; H404-H406 PolarHBondContact O-N 2.82Å; H404-Q407 PolarHBondContact O-N 3.19Å; H404-Y408 PolarHBondContact O-N 3.42Å
405	Q	63.2	Low	65.5	Low	68 Å²	68	74.3 Å²	74.3	32%	0.318	38%	0.384	S	S	.	.	H	α-helix	trans	-59.3	-35.5	173.5	-169.2	178.1	13.2	0	0	111.8	S401 L403 Y408 F427	S401-Q405 VanDerWaalsContact O-CB 3.28Å; S401-Q405 WeakPolarHBondContact O-CB 3.36Å; S401-Q405 PolarHBondContact O-N 3.31Å; L403-Q405 VanDerWaalsContact C-N 3.35Å; L403-Q405 PolarHBondContact O-N 3.35Å; Q405-Y408 WeakPolarHBondContact O-CB 3.4Å; Q405-F427 HydrophobicContact CB-CE1 4.48Å; Q405-F427 HydrophobicContact CG-CD1 3.95Å; Q405-F427 HydrophobicContact CG-CD2 4.49Å; Q405-F427 HydrophobicContact CG-CE1 3.4Å; Q405-F427 VanDerWaalsContact CG-CE1 3.4Å; Q405-F427 HydrophobicContact CG-CE2 4Å; Q405-F427 HydrophobicContact CG-CG 4.48Å; Q405-F427 HydrophobicContact CG-CZ 3.44Å; Q405-F427 VanDerWaalsContact CG-CZ 3.44Å; Q405-F427 VanDerWaalsContact O-CZ 3.23Å; Q405-F427 WeakPolarHBondContact O-CZ 3.46Å
406	H	69.6	Low	65.6	Low	22 Å²	22	72.6 Å²	72.6	10%	0.102	38%	0.376	C	S	.	.	H	α-helix	trans	-77	-36.9	176.1	-177.5	58.4	0	0	0	113.6	C393 F397 L402 L403 H404 Y408 L409 H410	C393-H406 PolarHBondContact SG-NE2 2.94Å; F397-H406 HydrophobicContact CE1-CB 3.9Å; F397-H406 AromaticContact CE1-CG 3.95Å; F397-H406 HydrophobicContact CE2-CB 3.9Å; F397-H406 AromaticContact CE2-CD2 3.3Å; F397-H406 WeakPolarHBondContact CE2-CD2 3.3Å; F397-H406 AromaticContact CE2-CG 3.66Å; F397-H406 HydrophobicContact CZ-CB 3.54Å; F397-H406 AromaticContact CZ-CD2 3.23Å; F397-H406 WeakPolarHBondContact CZ-CD2 3.24Å; F397-H406 AromaticContact CZ-CG 3.19Å; F397-H406 AromaticContact CZ-ND1 3.84Å; F397-H406 AromaticContact CZ-NE2 3.9Å; L402-H406 VanDerWaalsContact O-CB 3.24Å; L402-H406 WeakPolarHBondContact O-CB 3.37Å; L402-H406 PolarHBondContact O-N 3Å; L403-H406 CarbonylContact O-C 3.54Å; L403-H406 WeakPolarHBondContact O-CA 3.42Å; L403-H406 WeakPolarHBondContact O-CB 3.42Å; L403-H406 PolarHBondContact O-N 3.32Å; H404-H406 PolarHBondContact O-N 2.82Å; H406-Y408 PolarHBondContact O-N 3.31Å; H406-L409 VanDerWaalsContact O-CB 3.32Å; H406-L409 WeakPolarHBondContact O-CB 3.42Å; H406-L409 PolarHBondContact O-N 3.26Å; H406-H410 AromaticContact CD2-NE2 3.66Å; H406-H410 AromaticContact CE1-NE2 3.63Å; H406-H410 AromaticContact NE2-CE1 3.75Å; H406-H410 AromaticContact NE2-NE2 3.04Å; H406-H410 PolarHBondContact NE2-NE2 2.84Å
407	Q	69.9	Low	66.3	Low	56 Å²	56	74 Å²	74	26%	0.262	38%	0.376	S	S	.	.	H	α-helix	trans	-59.4	-37.1	172	-74.8	164.3	-47.9	0	0	110.8	L403 H404 L409 H410 T411	L403-Q407 HydrophobicContact CD1-CG 3.89Å; L403-Q407 HydrophobicContact CG-CG 4.37Å; L403-Q407 WeakPolarHBondContact O-CG 3.3Å; L403-Q407 PolarHBondContact O-N 3.26Å; L403-Q407 PolarHBondContact O-OE1 3.29Å; H404-Q407 PolarHBondContact O-N 3.19Å; Q407-L409 PolarHBondContact O-N 3.4Å; Q407-L409 VanDerWaalsContact O-N 3.12Å; Q407-H410 PolarHBondContact O-N 2.87Å; Q407-T411 PolarHBondContact O-N 3.14Å
408	Y	67.8	Low	67.1	Low	95 Å²	95	72 Å²	72	37%	0.373	37%	0.368	S	S	.	.	H	α-helix	trans	-63.3	-11.6	172	-131.8	-87.4	0	0	0	114.9	H404 Q405 H406 T411 P415	H404-Y408 PolarHBondContact O-N 3.42Å; Q405-Y408 WeakPolarHBondContact O-CB 3.4Å; H406-Y408 PolarHBondContact O-N 3.31Å; Y408-T411 PolarHBondContact O-OG1 3.27Å; Y408-P415 HydrophobicContact CE1-CG 3.98Å
409	L	63.4	Low	67.6	Low	94 Å²	94	71.8 Å²	71.8	49%	0.492	38%	0.377	S	S	.	.	H	α-helix	trans	-86.5	-20.7	170.4	-62.3	176.1	0	0	0	112.7	H406 Q407 A426 F427	H406-L409 VanDerWaalsContact O-CB 3.32Å; H406-L409 WeakPolarHBondContact O-CB 3.42Å; H406-L409 PolarHBondContact O-N 3.26Å; Q407-L409 PolarHBondContact O-N 3.4Å; Q407-L409 VanDerWaalsContact O-N 3.12Å; L409-A426 HydrophobicContact CD2-CB 4.23Å; L409-F427 HydrophobicContact CD2-CE2 3.82Å; L409-F427 HydrophobicContact CD2-CZ 3.61Å; L409-F427 HydrophobicContact CG-CE2 4.45Å; L409-F427 HydrophobicContact CG-CZ 3.95Å
410	H	66.6	Low	67.9	Low	69 Å²	69	71 Å²	71	32%	0.319	38%	0.376	S	S	.	.	H	α-helix	trans	-84	-31.7	175.2	-61.9	-60.9	0	0	0	112.1	I392 C393 H406 Q407 G412	I392-H410 HydrophobicContact CD1-CB 3.73Å; I392-H410 HydrophobicContact CG2-CB 4.04Å; C393-H410 PolarHBondContact SG-NE2 2.95Å; C393-H410 VanDerWaalsContact SG-NE2 3.39Å; H406-H410 AromaticContact CD2-NE2 3.66Å; H406-H410 AromaticContact CE1-NE2 3.63Å; H406-H410 AromaticContact NE2-CE1 3.75Å; H406-H410 AromaticContact NE2-NE2 3.04Å; H406-H410 PolarHBondContact NE2-NE2 2.84Å; Q407-H410 PolarHBondContact O-N 2.87Å; H410-G412 PolarHBondContact O-N 3.03Å
411	T	63.2	Low	68.7	Low	66 Å²	66	70.7 Å²	70.7	41%	0.405	37%	0.374	S	S	.	.	S	Bend	trans	-70.2	-14.3	174.1	60.9	0	0	0	0	113.3	Q407 Y408 Q413	Q407-T411 PolarHBondContact O-N 3.14Å; Y408-T411 PolarHBondContact O-OG1 3.27Å; T411-Q413 PolarHBondContact O-N 3.49Å
412	G	60	Low	69.3	Low	52 Å²	52	69.2 Å²	69.2	54%	0.536	37%	0.371	S	S	.	.			trans	68.4	-8.8	173.9	0	0	0	0	0	116.1	H410	H410-G412 PolarHBondContact O-N 3.03Å
413	Q	55.5	Low	69.7	Low	76 Å²	76	71.4 Å²	71.4	36%	0.355	38%	0.377	S	S	.	.			trans	-66.2	145.9	-177.2	-65.1	-168.9	11.5	0	0	111.8	Q207 T411	Q207-Q413 VanDerWaalsContact NE2-NE2 3.11Å; T411-Q413 PolarHBondContact O-N 3.49Å
414	K	65.1	Low	69.7	Low	123 Å²	123	77.7 Å²	77.7	54%	0.535	40%	0.404	S	S	.	.			trans	-131.2	75.4	179.6	-64.4	-177.5	-174.7	175.4	0	110.3	F416 K424 F425	K414-F416 VanDerWaalsContact C-N 3.28Å; K414-F416 PolarHBondContact O-N 2.93Å; K414-K424 HydrophobicContact CB-CB 3.85Å; K414-K424 HydrophobicContact CD-CB 4.37Å; K414-F425 CarbonylContact C-O 3.41Å; K414-F425 VanDerWaalsContact C-O 3.31Å; K414-F425 VanDerWaalsContact CA-O 3.29Å; K414-F425 WeakPolarHBondContact CA-O 3.14Å
415	P	69	Low	70.3	Confident	58 Å²	58	74 Å²	74	38%	0.377	39%	0.386	S	S	.	.			trans	-66.7	-30.6	-172.1	-19.2	32.5	0	0	0	113	Y408 H417	Y408-P415 HydrophobicContact CE1-CG 3.98Å; P415-H417 PolarHBondContact O-N 3.36Å
416	F	71.9	Confident	70.7	Confident	78 Å²	78	71.5 Å²	71.5	34%	0.342	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	102.5	-169.5	-55.5	-75.4	0	0	0	110.7	K414 K424 F425 A426 F427 A428 M431	K414-F416 VanDerWaalsContact C-N 3.28Å; K414-F416 PolarHBondContact O-N 2.93Å; F416-K424 CarbonylContact O-C 3.51Å; F416-F425 HydrophobicContact CB-CB 4.48Å; F416-F425 PolarHBondContact N-O 2.87Å; F416-F425 PolarHBondContact O-N 2.87Å; F416-A426 WeakPolarHBondContact CD2-O 3.34Å; F416-A426 WeakPolarHBondContact CE2-O 3.43Å; F416-F427 VanDerWaalsContact CD2-C 3.48Å; F416-A428 HydrophobicContact CD1-CB 3.73Å; F416-A428 HydrophobicContact CD2-CB 4.48Å; F416-A428 VanDerWaalsContact CD2-N 3.28Å; F416-A428 HydrophobicContact CE1-CB 3.75Å; F416-A428 HydrophobicContact CE2-CB 4.48Å; F416-A428 HydrophobicContact CG-CB 4.1Å; F416-A428 HydrophobicContact CZ-CB 4.14Å; F416-M431 HydrophobicContact CB-CB 4.06Å; F416-M431 HydrophobicContact CB-CG 4.34Å; F416-M431 HydrophobicContact CB-SD 3.86Å
417	H	72.5	Confident	71	Confident	117 Å²	117	72 Å²	72	54%	0.542	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	139.4	173.7	59.9	-87.1	0	0	0	110.6	P415 P419 K423	P415-H417 PolarHBondContact O-N 3.36Å; H417-P419 WeakPolarHBondContact O-CD 3.43Å; H417-K423 WeakPolarHBondContact CA-O 3.11Å
418	C	85.9	Confident	71.1	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	38%	0.384	C	S	.	.			trans	-71.7	119.6	170.7	-170.8	0	0	0	0	109.3	E420 C421 G422 K423 F425 H434 H438	C418-E420 VanDerWaalsContact C-N 3.3Å; C418-E420 PolarHBondContact O-N 3.3Å; C418-E420 PolarHBondContact SG-OE2 2.85Å; C418-C421 PolarHBondContact O-N 3.35Å; C418-G422 WeakPolarHBondContact O-CA 3.07Å; C418-G422 PolarHBondContact O-N 3.18Å; C418-K423 HydrophobicContact CB-CB 4.42Å; C418-K423 PolarHBondContact N-O 2.86Å; C418-F425 HydrophobicContact CB-CE2 4.19Å; C418-H434 PolarHBondContact SG-CD2 3.44Å; C418-H438 PolarHBondContact SG-CD2 3.14Å; C418-H438 PolarHBondContact SG-NE2 3.49Å; C418-H438 VanDerWaalsContact SG-NE2 3.45Å
419	P	74.8	Confident	71.4	Confident	97 Å²	97	73.6 Å²	73.6	63%	0.63	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-37.7	179.2	25.3	-33.3	0	0	0	111.5	H417 C421	H417-P419 WeakPolarHBondContact O-CD 3.43Å; P419-C421 VanDerWaalsContact C-N 3.29Å; P419-C421 PolarHBondContact O-N 3.04Å
420	E	71.9	Confident	71.9	Confident	78 Å²	78	73.2 Å²	73.2	36%	0.364	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-6.4	-176.9	-50.5	107.9	154.2	0	0	114.7	C418 C435 H438	C418-E420 VanDerWaalsContact C-N 3.3Å; C418-E420 PolarHBondContact O-N 3.3Å; C418-E420 PolarHBondContact SG-OE2 2.85Å; E420-C435 PolarHBondContact OE2-SG 2.64Å; E420-H438 HydrophobicContact CB-CB 3.96Å; E420-H438 HydrophobicContact CG-CB 4.01Å; E420-H438 IonicContact OE2-CD2 3.84Å; E420-H438 PolarHBondContact OE2-CD2 3.43Å
421	C	80.6	Confident	72.7	Confident	51 Å²	51	71.9 Å²	71.9	35%	0.345	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-161.3	13.3	179	72.9	0	0	0	0	117.4	C418 P419 K423 H434 H438	C418-C421 PolarHBondContact O-N 3.35Å; P419-C421 VanDerWaalsContact C-N 3.29Å; P419-C421 PolarHBondContact O-N 3.04Å; C421-K423 PolarHBondContact O-N 2.9Å; C421-H434 PolarHBondContact SG-NE2 3.33Å; C421-H438 PolarHBondContact SG-NE2 2.81Å
422	G	76.9	Confident	73.4	Confident	47 Å²	47	75.3 Å²	75.3	49%	0.485	40%	0.4	S	S	.	.			trans	68.7	-8.2	176.4	0	0	0	0	0	117.4	C418 K424	C418-G422 WeakPolarHBondContact O-CA 3.07Å; C418-G422 PolarHBondContact O-N 3.18Å; G422-K424 PolarHBondContact O-N 2.81Å
423	K	77.8	Confident	74.2	Confident	113 Å²	113	75.4 Å²	75.4	49%	0.491	40%	0.396	S	S	.	.			trans	-61.1	127.7	-177.4	-70.4	174.8	-164.9	155.4	0	111.6	H417 C418 C421 F425	H417-K423 WeakPolarHBondContact CA-O 3.11Å; C418-K423 HydrophobicContact CB-CB 4.42Å; C418-K423 PolarHBondContact N-O 2.86Å; C421-K423 PolarHBondContact O-N 2.9Å; K423-F425 HydrophobicContact CB-CE2 3.75Å; K423-F425 HydrophobicContact CB-CZ 4.07Å; K423-F425 VanDerWaalsContact O-CD2 3.24Å; K423-F425 WeakPolarHBondContact O-CD2 3.42Å; K423-F425 WeakPolarHBondContact O-CE2 3.18Å
424	K	74.2	Confident	75.4	Confident	149 Å²	149	72.6 Å²	72.6	65%	0.648	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	134.6	-176.3	-55.3	-174.1	-178.4	-176.8	0	111.9	K414 F416 G422	K414-K424 HydrophobicContact CB-CB 3.85Å; K414-K424 HydrophobicContact CD-CB 4.37Å; F416-K424 CarbonylContact O-C 3.51Å; G422-K424 PolarHBondContact O-N 2.81Å
425	F	75.8	Confident	75.9	Confident	44 Å²	44	67.4 Å²	67.4	19%	0.193	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	147.7	-177.5	-61.6	-90.4	0	0	0	111.4	K414 F416 C418 K423 F427 N430 M431 H434	K414-F425 CarbonylContact C-O 3.41Å; K414-F425 VanDerWaalsContact C-O 3.31Å; K414-F425 VanDerWaalsContact CA-O 3.29Å; K414-F425 WeakPolarHBondContact CA-O 3.14Å; F416-F425 HydrophobicContact CB-CB 4.48Å; F416-F425 PolarHBondContact N-O 2.87Å; F416-F425 PolarHBondContact O-N 2.87Å; C418-F425 HydrophobicContact CB-CE2 4.19Å; K423-F425 HydrophobicContact CB-CE2 3.75Å; K423-F425 HydrophobicContact CB-CZ 4.07Å; K423-F425 VanDerWaalsContact O-CD2 3.24Å; K423-F425 WeakPolarHBondContact O-CD2 3.42Å; K423-F425 WeakPolarHBondContact O-CE2 3.18Å; F425-F427 VanDerWaalsContact C-N 3.29Å; F425-F427 PolarHBondContact O-N 3.33Å; F425-N430 HydrophobicContact CB-CB 4.49Å; F425-N430 HydrophobicContact CD1-CB 3.96Å; F425-M431 HydrophobicContact CB-CB 4.18Å; F425-M431 HydrophobicContact CD2-CB 3.85Å; F425-M431 HydrophobicContact CD2-CG 4.1Å; F425-M431 HydrophobicContact CG-CB 4.14Å; F425-H434 HydrophobicContact CE1-CB 4.22Å; F425-H434 HydrophobicContact CE2-CB 4.13Å; F425-H434 AromaticContact CE2-CD2 3.63Å; F425-H434 HydrophobicContact CZ-CB 3.62Å; F425-H434 AromaticContact CZ-CD2 3.46Å; F425-H434 VanDerWaalsContact CZ-CD2 3.46Å; F425-H434 WeakPolarHBondContact CZ-CD2 3.47Å; F425-H434 AromaticContact CZ-CG 3.59Å
426	A	72.3	Confident	76.4	Confident	16 Å²	16	72.6 Å²	72.6	13%	0.132	37%	0.374	C	S	.	.	S	Bend	trans	-68.9	-26.3	174.3	0	0	0	0	0	112.9	L409 F416	L409-A426 HydrophobicContact CD2-CB 4.23Å; F416-A426 WeakPolarHBondContact CD2-O 3.34Å; F416-A426 WeakPolarHBondContact CE2-O 3.43Å
427	F	76.4	Confident	76.5	Confident	32 Å²	32	74.6 Å²	74.6	14%	0.14	38%	0.384	C	S	.	.	S	Bend	trans	-134.2	139	-175.5	-48.1	-55.8	0	0	0	112.7	Q405 L409 F416 F425 Q429 N430 M431	Q405-F427 HydrophobicContact CB-CE1 4.48Å; Q405-F427 HydrophobicContact CG-CD1 3.95Å; Q405-F427 HydrophobicContact CG-CD2 4.49Å; Q405-F427 HydrophobicContact CG-CE1 3.4Å; Q405-F427 VanDerWaalsContact CG-CE1 3.4Å; Q405-F427 HydrophobicContact CG-CE2 4Å; Q405-F427 HydrophobicContact CG-CG 4.48Å; Q405-F427 HydrophobicContact CG-CZ 3.44Å; Q405-F427 VanDerWaalsContact CG-CZ 3.44Å; Q405-F427 VanDerWaalsContact O-CZ 3.23Å; Q405-F427 WeakPolarHBondContact O-CZ 3.46Å; L409-F427 HydrophobicContact CD2-CE2 3.82Å; L409-F427 HydrophobicContact CD2-CZ 3.61Å; L409-F427 HydrophobicContact CG-CE2 4.45Å; L409-F427 HydrophobicContact CG-CZ 3.95Å; F416-F427 VanDerWaalsContact CD2-C 3.48Å; F425-F427 VanDerWaalsContact C-N 3.29Å; F425-F427 PolarHBondContact O-N 3.33Å; F427-Q429 PolarHBondContact O-N 2.87Å; F427-N430 PolarHBondContact O-N 3.25Å; F427-N430 VanDerWaalsContact O-N 3.08Å; F427-M431 PolarHBondContact O-N 3.23Å; F427-M431 VanDerWaalsContact O-N 3.1Å
428	A	71.6	Confident	76.6	Confident	44 Å²	44	70.5 Å²	70.5	36%	0.364	37%	0.365	S	S	.	.	H	α-helix	trans	-55.8	-30.4	173.2	0	0	0	0	0	113.3	F416 K432	F416-A428 HydrophobicContact CD1-CB 3.73Å; F416-A428 HydrophobicContact CD2-CB 4.48Å; F416-A428 VanDerWaalsContact CD2-N 3.28Å; F416-A428 HydrophobicContact CE1-CB 3.75Å; F416-A428 HydrophobicContact CE2-CB 4.48Å; F416-A428 HydrophobicContact CG-CB 4.1Å; F416-A428 HydrophobicContact CZ-CB 4.14Å; A428-K432 WeakPolarHBondContact O-CB 3.44Å; A428-K432 PolarHBondContact O-N 2.86Å
429	Q	73.3	Confident	75.6	Confident	141 Å²	141	78.7 Å²	78.7	66%	0.659	40%	0.396	S	S	*	.	H	α-helix	trans	-65.6	-43.3	176.1	-68.3	-178.2	-5	0	0	112.1	F427 K432 A433	F427-Q429 PolarHBondContact O-N 2.87Å; Q429-K432 PolarHBondContact O-N 3.06Å; Q429-A433 WeakPolarHBondContact O-CB 3.4Å; Q429-A433 PolarHBondContact O-N 3.28Å
430	N	74.9	Confident	74.8	Confident	86 Å²	86	79.7 Å²	79.7	46%	0.46	40%	0.396	S	S	.	.	H	α-helix	trans	-70.6	-39.1	178.5	-67.6	3	0	0	0	110.9	F425 F427 A433 H434	F425-N430 HydrophobicContact CB-CB 4.49Å; F425-N430 HydrophobicContact CD1-CB 3.96Å; F427-N430 PolarHBondContact O-N 3.25Å; F427-N430 VanDerWaalsContact O-N 3.08Å; N430-A433 PolarHBondContact O-N 3.48Å; N430-H434 WeakPolarHBondContact O-CB 3.23Å; N430-H434 PolarHBondContact O-N 3.14Å
431	M	82.3	Confident	74	Confident	41 Å²	41	83.5 Å²	83.5	20%	0.202	41%	0.406	C	S	.	.	H	α-helix	trans	-59.1	-48.6	170.1	-174.9	-152.9	79.2	0	0	111.2	F416 F425 F427 A433 H434 C435	F416-M431 HydrophobicContact CB-CB 4.06Å; F416-M431 HydrophobicContact CB-CG 4.34Å; F416-M431 HydrophobicContact CB-SD 3.86Å; F425-M431 HydrophobicContact CB-CB 4.18Å; F425-M431 HydrophobicContact CD2-CB 3.85Å; F425-M431 HydrophobicContact CD2-CG 4.1Å; F425-M431 HydrophobicContact CG-CB 4.14Å; F427-M431 PolarHBondContact O-N 3.23Å; F427-M431 VanDerWaalsContact O-N 3.1Å; M431-A433 PolarHBondContact O-N 3.41Å; M431-H434 CarbonylContact O-C 3.56Å; M431-H434 WeakPolarHBondContact O-CA 3.41Å; M431-H434 WeakPolarHBondContact O-CB 3.15Å; M431-H434 PolarHBondContact O-N 3.07Å; M431-C435 PolarHBondContact O-N 3.39Å; M431-C435 PolarHBondContact O-SG 3.27Å
432	K	77.6	Confident	72.3	Confident	138 Å²	138	85.6 Å²	85.6	60%	0.6	41%	0.414	S	S	*	.	H	α-helix	trans	-68.6	-31.4	-179.2	-166.6	167.5	-171.7	169.7	0	112.8	A428 Q429 H434 R436	A428-K432 WeakPolarHBondContact O-CB 3.44Å; A428-K432 PolarHBondContact O-N 2.86Å; Q429-K432 PolarHBondContact O-N 3.06Å; K432-H434 VanDerWaalsContact C-N 3.3Å; K432-R436 WeakPolarHBondContact O-CG 3.42Å; K432-R436 PolarHBondContact O-N 2.99Å
433	A	78.4	Confident	70.7	Confident	54 Å²	54	88.1 Å²	88.1	45%	0.446	42%	0.421	S	S	.	.	H	α-helix	trans	-67.1	-32.1	168.6	0	0	0	0	0	112.1	Q429 N430 M431	Q429-A433 WeakPolarHBondContact O-CB 3.4Å; Q429-A433 PolarHBondContact O-N 3.28Å; N430-A433 PolarHBondContact O-N 3.48Å; M431-A433 PolarHBondContact O-N 3.41Å
434	H	79.7	Confident	69	Low	18 Å²	18	87.2 Å²	87.2	8%	0.083	42%	0.421	C	S	.	.	H	α-helix	trans	-76.9	-44.1	173.9	-177.6	45.9	0	0	0	113.1	C418 C421 F425 N430 M431 K432 R436 Q437 H438	C418-H434 PolarHBondContact SG-CD2 3.44Å; C421-H434 PolarHBondContact SG-NE2 3.33Å; F425-H434 HydrophobicContact CE1-CB 4.22Å; F425-H434 HydrophobicContact CE2-CB 4.13Å; F425-H434 AromaticContact CE2-CD2 3.63Å; F425-H434 HydrophobicContact CZ-CB 3.62Å; F425-H434 AromaticContact CZ-CD2 3.46Å; F425-H434 VanDerWaalsContact CZ-CD2 3.46Å; F425-H434 WeakPolarHBondContact CZ-CD2 3.47Å; F425-H434 AromaticContact CZ-CG 3.59Å; N430-H434 WeakPolarHBondContact O-CB 3.23Å; N430-H434 PolarHBondContact O-N 3.14Å; M431-H434 CarbonylContact O-C 3.56Å; M431-H434 WeakPolarHBondContact O-CA 3.41Å; M431-H434 WeakPolarHBondContact O-CB 3.15Å; M431-H434 PolarHBondContact O-N 3.07Å; K432-H434 VanDerWaalsContact C-N 3.3Å; H434-R436 PolarHBondContact O-N 3.32Å; H434-Q437 PolarHBondContact ND1-OE1 3.07Å; H434-Q437 WeakPolarHBondContact O-CA 3.45Å; H434-Q437 WeakPolarHBondContact O-CB 3.5Å; H434-Q437 PolarHBondContact O-N 2.94Å; H434-H438 AromaticContact CD2-NE2 3.74Å; H434-H438 AromaticContact CE1-CE1 3.79Å; H434-H438 AromaticContact CE1-NE2 3.36Å; H434-H438 PolarHBondContact CE1-NE2 3.29Å; H434-H438 AromaticContact NE2-CE1 3.76Å; H434-H438 AromaticContact NE2-NE2 3.03Å; H434-H438 PolarHBondContact NE2-NE2 3.36Å
435	C	75.8	Confident	67.2	Low	13 Å²	13	85.3 Å²	85.3	9%	0.088	43%	0.426	C	S	.	.	H	α-helix	trans	-59.7	-28.6	174.5	-61.8	0	0	0	0	112.8	E420 M431 Q437 H438 R439	E420-C435 PolarHBondContact OE2-SG 2.64Å; M431-C435 PolarHBondContact O-N 3.39Å; M431-C435 PolarHBondContact O-SG 3.27Å; C435-Q437 PolarHBondContact O-N 2.78Å; C435-H438 PolarHBondContact O-N 2.95Å; C435-H438 VanDerWaalsContact O-N 3.14Å; C435-R439 PolarHBondContact O-N 3.07Å
436	R	79.9	Confident	65.4	Low	168 Å²	168	88.3 Å²	88.3	63%	0.634	45%	0.453	S	S	*	.	H	α-helix	trans	-60.1	-26.2	169.4	-77	170.6	178.3	-170.7	-2.3	113.1	K432 H434 L440	K432-R436 WeakPolarHBondContact O-CG 3.42Å; K432-R436 PolarHBondContact O-N 2.99Å; H434-R436 PolarHBondContact O-N 3.32Å; R436-L440 WeakPolarHBondContact O-CB 3.19Å; R436-L440 WeakPolarHBondContact O-CD1 3.46Å; R436-L440 WeakPolarHBondContact O-CG 3.21Å; R436-L440 PolarHBondContact O-N 3.46Å
437	Q	72.8	Confident	63.5	Low	119 Å²	119	93.8 Å²	93.8	56%	0.556	48%	0.484	S	S	*	.	H	α-helix	trans	-76	-30.9	176.1	-55.6	174.4	-32.3	0	0	111.7	H434 C435	H434-Q437 PolarHBondContact ND1-OE1 3.07Å; H434-Q437 WeakPolarHBondContact O-CA 3.45Å; H434-Q437 WeakPolarHBondContact O-CB 3.5Å; H434-Q437 PolarHBondContact O-N 2.94Å; C435-Q437 PolarHBondContact O-N 2.78Å
438	H	76.3	Confident	61.2	Low	31 Å²	31	100.6 Å²	100.6	14%	0.144	52%	0.517	C	S	.	.	H	α-helix	trans	-75.7	-47.4	173.1	-59.4	-55.1	0	0	0	111.4	C418 E420 C421 H434 C435 L440 R441 D442	C418-H438 PolarHBondContact SG-CD2 3.14Å; C418-H438 PolarHBondContact SG-NE2 3.49Å; C418-H438 VanDerWaalsContact SG-NE2 3.45Å; E420-H438 HydrophobicContact CB-CB 3.96Å; E420-H438 HydrophobicContact CG-CB 4.01Å; E420-H438 IonicContact OE2-CD2 3.84Å; E420-H438 PolarHBondContact OE2-CD2 3.43Å; C421-H438 PolarHBondContact SG-NE2 2.81Å; H434-H438 AromaticContact CD2-NE2 3.74Å; H434-H438 AromaticContact CE1-CE1 3.79Å; H434-H438 AromaticContact CE1-NE2 3.36Å; H434-H438 PolarHBondContact CE1-NE2 3.29Å; H434-H438 AromaticContact NE2-CE1 3.76Å; H434-H438 AromaticContact NE2-NE2 3.03Å; H434-H438 PolarHBondContact NE2-NE2 3.36Å; C435-H438 PolarHBondContact O-N 2.95Å; C435-H438 VanDerWaalsContact O-N 3.14Å; H438-L440 PolarHBondContact O-N 2.8Å; H438-L440 VanDerWaalsContact O-N 3.13Å; H438-R441 VanDerWaalsContact O-CA 3.29Å; H438-R441 WeakPolarHBondContact O-CA 3.45Å; H438-R441 WeakPolarHBondContact O-CB 3.37Å; H438-R441 PolarHBondContact O-N 2.9Å; H438-D442 VanDerWaalsContact O-CG 3.26Å; H438-D442 PolarHBondContact O-N 3.4Å
439	R	64.5	Low	59.7	Low	172 Å²	172	103.3 Å²	103.3	65%	0.649	53%	0.531	S	S	*	.	H	α-helix	trans	-58.2	-30.6	175.2	-70.1	-174.1	174.4	-147.7	-6.3	114.1	C435 R441 D442 T443	C435-R439 PolarHBondContact O-N 3.07Å; R439-R441 VanDerWaalsContact C-N 3.28Å; R439-D442 WeakPolarHBondContact CA-OD2 3.32Å; R439-T443 WeakPolarHBondContact O-CB 2.88Å; R439-T443 WeakPolarHBondContact O-CG2 3.3Å; R439-T443 PolarHBondContact O-N 2.89Å; R439-T443 VanDerWaalsContact O-N 3.12Å; R439-T443 PolarHBondContact O-OG1 3.02Å
440	L	58.6	Low	58.3	Low	119 Å²	119	103.1 Å²	103.1	62%	0.623	54%	0.541	S	S	*	.	H	α-helix	trans	-74	-16.4	172.2	-75.7	170.2	0	0	0	113.4	R436 H438 N444	R436-L440 WeakPolarHBondContact O-CB 3.19Å; R436-L440 WeakPolarHBondContact O-CD1 3.46Å; R436-L440 WeakPolarHBondContact O-CG 3.21Å; R436-L440 PolarHBondContact O-N 3.46Å; H438-L440 PolarHBondContact O-N 2.8Å; H438-L440 VanDerWaalsContact O-N 3.13Å; L440-N444 PolarHBondContact O-ND2 3.19Å
441	R	54.1	Low	56.1	Low	157 Å²	157	102.4 Å²	102.4	59%	0.592	56%	0.555	S	S	*	*	H	α-helix	trans	-82.4	-47.3	168.4	-163.2	179.6	-177.5	-164.7	-4.4	110.3	H438 R439 T443 N444 D475	H438-R441 VanDerWaalsContact O-CA 3.29Å; H438-R441 WeakPolarHBondContact O-CA 3.45Å; H438-R441 WeakPolarHBondContact O-CB 3.37Å; H438-R441 PolarHBondContact O-N 2.9Å; R439-R441 VanDerWaalsContact C-N 3.28Å; R441-T443 PolarHBondContact O-N 3.36Å; R441-N444 WeakPolarHBondContact O-CB 3.5Å; R441-N444 PolarHBondContact O-N 3.16Å; R441-D475 IonicContact NH2-OD2 2.69Å; R441-D475 PolarHBondContact NH2-OD2 3.31Å
442	D	45.1	Very low	53.8	Low	95 Å²	95	110.7 Å²	110.7	51%	0.508	59%	0.589	S	S	.	*	H	α-helix	trans	-62.6	-41.5	-177	-46.8	-35.6	0	0	0	112.1	H438 R439 N444 S445	H438-D442 VanDerWaalsContact O-CG 3.26Å; H438-D442 PolarHBondContact O-N 3.4Å; R439-D442 WeakPolarHBondContact CA-OD2 3.32Å; D442-N444 PolarHBondContact O-N 3.29Å; D442-N444 VanDerWaalsContact O-N 3.12Å; D442-S445 PolarHBondContact O-N 3.01Å
443	T	43.5	Very low	51.6	Low	101 Å²	101	113 Å²	113	62%	0.62	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-5.6	176	47.9	0	0	0	0	114.8	R439 R441	R439-T443 WeakPolarHBondContact O-CB 2.88Å; R439-T443 WeakPolarHBondContact O-CG2 3.3Å; R439-T443 PolarHBondContact O-N 2.89Å; R439-T443 VanDerWaalsContact O-N 3.12Å; R439-T443 PolarHBondContact O-OG1 3.02Å; R441-T443 PolarHBondContact O-N 3.36Å
444	N	42.2	Very low	49.6	Very low	94 Å²	94	115.6 Å²	115.6	50%	0.503	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.3	3.4	171.4	-83.3	-91.3	0	0	0	113.2	L440 R441 D442 R478	L440-N444 PolarHBondContact O-ND2 3.19Å; R441-N444 WeakPolarHBondContact O-CB 3.5Å; R441-N444 PolarHBondContact O-N 3.16Å; D442-N444 PolarHBondContact O-N 3.29Å; D442-N444 VanDerWaalsContact O-N 3.12Å; N444-R478 PolarHBondContact OD1-NH1 3.28Å
445	S	36.6	Very low	47.1	Very low	108 Å²	108	121.7 Å²	121.7	76%	0.755	65%	0.647	S	S	*	*	S	Bend	trans	-113.9	11.5	-174.8	-165.2	0	0	0	0	114.7	D442	D442-S445 PolarHBondContact O-N 3.01Å
446	S	37.8	Very low	44.7	Very low	108 Å²	108	126.5 Å²	126.5	76%	0.755	68%	0.676	S	S	*	*			trans	-151.1	75	-176.9	-166.3	0	0	0	0	113.2
447	V	32.9	Very low	42.1	Very low	130 Å²	130	124.5 Å²	124.5	79%	0.788	69%	0.688	S	S	*	*			trans	-148.2	113.8	154.2	-178.8	0	0	0	0	107.8
448	E	27.9	Very low	39.9	Very low	176 Å²	176	122.6 Å²	122.6	82%	0.822	70%	0.701	S	S	*	*			trans	-156.8	145.1	148.3	-95.7	-53.8	101.2	0	0	107.5
449	P	39.8	Very low	37.7	Very low	101 Å²	101	129.1 Å²	129.1	66%	0.656	73%	0.731	S	S	*	*			trans	-92.7	168	-174.5	36.4	-33.6	0	0	0	114.1
450	P	42.8	Very low	35.8	Very low	136 Å²	136	128.8 Å²	128.8	88%	0.883	74%	0.736	S	S	*	*			trans	-92.1	147.1	-168.7	35	-35.6	0	0	0	115.2
451	G	29.9	Very low	34.3	Very low	72 Å²	72	127.5 Å²	127.5	74%	0.742	74%	0.743	S	S	*	*			trans	-173.2	74.9	177	0	0	0	0	0	119.7
452	K	33.5	Very low	33	Very low	214 Å²	214	124.4 Å²	124.4	93%	0.93	75%	0.751	S	S	*	*			trans	71.1	145.3	152.5	-56	179.3	-178.8	179.1	0	120.5
453	Q	32.4	Very low	32.2	Very low	186 Å²	186	130 Å²	130	87%	0.869	77%	0.771	S	S	*	*			trans	-97.4	177.9	173.6	-89.5	-175.4	-5.2	0	0	110
454	P	35.8	Very low	31.3	Very low	109 Å²	109	128.2 Å²	128.2	71%	0.708	77%	0.773	S	S	*	*			cis	-158.1	-171.6	36.2	46.4	-23.4	0	0	0	121.3
455	L	26.9	Very low	31.1	Very low	147 Å²	147	129.6 Å²	129.6	77%	0.77	79%	0.787	S	S	*	*			trans	85.8	98.5	149.5	-105.1	71.3	0	0	0	123.7
456	T	25.4	Very low	30.5	Very low	113 Å²	113	131.2 Å²	131.2	69%	0.693	78%	0.782	S	S	*	*				65.2	128.8	122.1	54.9	0	0	0	0	126.3
457	S	25.9	Very low	30.2	Very low	127 Å²	127	134.2 Å²	134.2	89%	0.888	78%	0.782	S	S	*	*			trans	87.4	138.5	138.3	73.8	0	0	0	0	121.1
458	G	26.8	Very low	29.8	Very low	79 Å²	79	136.3 Å²	136.3	81%	0.814	78%	0.783	S	S	*	*			trans	155.9	108.9	176.6	0	0	0	0	0	114.4
459	H	29.1	Very low	30	Very low	168 Å²	168	134.8 Å²	134.8	78%	0.778	78%	0.781	S	S	*	*			trans	-61	150.2	-165.5	-82.7	-119.7	0	0	0	120.8
460	E	24.5	Very low	29.7	Very low	164 Å²	164	135.6 Å²	135.6	77%	0.766	78%	0.784	S	S	*	*			trans	51.8	111.1	133	-63.1	-179	98.5	0	0	125
461	A	26.6	Very low	29.1	Very low	92 Å²	92	137.4 Å²	137.4	76%	0.76	78%	0.78	S	S	*	*				60.9	126.5	109	0	0	0	0	0	125.1
462	A	27.2	Very low	29.4	Very low	92 Å²	92	139.2 Å²	139.2	76%	0.76	78%	0.777	S	S	*	*			trans	76.6	100	133.3	0	0	0	0	0	123
463	K	28	Very low	29.2	Very low	212 Å²	212	135.6 Å²	135.6	92%	0.922	77%	0.773	S	S	*	*				177.3	148.1	104.7	-98.4	178.6	177.9	179.1	0	113.5
464	G	25.4	Very low	29.6	Very low	64 Å²	64	135 Å²	135	66%	0.66	77%	0.77	S	S	*	*			trans	-111.6	-163.4	156.2	0	0	0	0	0	109.9
465	P	38.7	Very low	29.5	Very low	124 Å²	124	135.4 Å²	135.4	81%	0.805	77%	0.767	S	S	*	*			cis	-112.7	-162	8.1	29.6	-6.3	0	0	0	110.9
466	E	22.6	Very low	30.4	Very low	141 Å²	141	134.9 Å²	134.9	66%	0.659	77%	0.769	S	S	*	*			cis	-152.4	157.1	26.2	-69.3	-167.7	97.9	0	0	115.1
467	K	31.3	Very low	31.5	Very low	171 Å²	171	136.2 Å²	136.2	74%	0.743	77%	0.766	S	S	*	*			trans	61.9	140.9	139	-73.4	165.7	-176.9	156.6	0	123.5
468	E	26.4	Very low	32.8	Very low	174 Å²	174	139.8 Å²	139.8	81%	0.813	76%	0.76	S	S	*	*			trans	66.1	93.2	158.1	-62.4	-163.7	131.7	0	0	122.2
469	N	30.1	Very low	34.1	Very low	144 Å²	144	139.2 Å²	139.2	77%	0.77	74%	0.741	S	S	*	*				40	114.6	124.3	-64.1	-27.5	0	0	0	120.5
470	T	33.7	Very low	35.6	Very low	118 Å²	118	136 Å²	136	72%	0.724	72%	0.724	S	S	*	*				151.9	114	109.3	-63	0	0	0	0	111.7
471	H	30	Very low	36.8	Very low	174 Å²	174	130 Å²	130	81%	0.806	71%	0.707	S	S	*	*			trans	171.3	115.5	152.9	-93.7	-61.9	0	0	0	107.1
472	T	36.4	Very low	38.6	Very low	110 Å²	110	126.3 Å²	126.3	68%	0.675	68%	0.675	S	S	*	*				59.2	93.7	78.5	70.8	0	0	0	0	116.6
473	T	29.6	Very low	40.1	Very low	138 Å²	138	126.8 Å²	126.8	85%	0.847	67%	0.67	S	S	*	*			trans	-135.9	121.1	148.7	43.9	0	0	0	0	106.9
474	E	42.4	Very low	41.4	Very low	173 Å²	173	121.8 Å²	121.8	81%	0.808	65%	0.654	S	S	*	*				77.1	48.9	56.1	-69.9	-80	103.1	0	0	114.6	T476	E474-T476 PolarHBondContact O-N 3.48Å
475	D	33.3	Very low	43.3	Very low	119 Å²	119	120.5 Å²	120.5	64%	0.636	63%	0.634	S	S	*	*			trans	-73.5	106.4	167.9	-133.1	19.2	0	0	0	110.8	R441 K477	R441-D475 IonicContact NH2-OD2 2.69Å; R441-D475 PolarHBondContact NH2-OD2 3.31Å; D475-K477 PolarHBondContact O-N 3.07Å
476	T	46	Very low	44.4	Very low	135 Å²	135	120.7 Å²	120.7	83%	0.828	64%	0.635	S	S	*	*			trans	-72.5	85.5	-171.7	37.2	0	0	0	0	113.6	E474 R478	E474-T476 PolarHBondContact O-N 3.48Å; T476-R478 PolarHBondContact O-N 2.82Å; T476-R478 VanDerWaalsContact O-N 3.12Å
477	K	47.2	Very low	46.1	Very low	142 Å²	142	119 Å²	119	62%	0.617	63%	0.627	S	S	*	*			trans	-60.4	111.9	174.4	-66.2	156	-170	128.7	0	110.9	D475 T479 Y490	D475-K477 PolarHBondContact O-N 3.07Å; K477-T479 PolarHBondContact O-N 3.14Å; K477-Y490 HydrophobicContact CB-CD1 4.46Å; K477-Y490 HydrophobicContact CB-CE1 4.46Å
478	R	54	Low	47.4	Very low	202 Å²	202	114.1 Å²	114.1	76%	0.762	61%	0.612	S	S	*	*			trans	-52.5	104.7	179.9	-147.8	174.3	-161.4	176.9	7.5	111.6	N444 T476	N444-R478 PolarHBondContact OD1-NH1 3.28Å; T476-R478 PolarHBondContact O-N 2.82Å; T476-R478 VanDerWaalsContact O-N 3.12Å
479	T	53.1	Low	49.8	Very low	67 Å²	67	107.5 Å²	107.5	41%	0.411	58%	0.58	S	S	.	*			trans	-89	132.8	-177.2	36.3	0	0	0	0	111.5	K477 G481 T488 Y490	K477-T479 PolarHBondContact O-N 3.14Å; T479-G481 PolarHBondContact O-N 3.14Å; T479-T488 HydrophobicContact CG2-CG2 4.38Å; T479-Y490 HydrophobicContact CG2-CD1 3.97Å; T479-Y490 HydrophobicContact CG2-CE1 3.54Å
480	F	62.2	Low	51.6	Low	99 Å²	99	108.3 Å²	108.3	43%	0.434	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.7	91	166	-59.4	-81.9	0	0	0	108.4	F489 A492 L495	F480-F489 WeakPolarHBondContact CB-O 3.48Å; F480-F489 WeakPolarHBondContact CD2-O 3.26Å; F480-F489 PolarHBondContact N-O 2.93Å; F480-F489 PolarHBondContact O-N 3.34Å; F480-A492 HydrophobicContact CD1-CB 4.35Å; F480-A492 HydrophobicContact CD2-CB 4.33Å; F480-A492 HydrophobicContact CE1-CB 4.24Å; F480-A492 HydrophobicContact CE2-CB 4.23Å; F480-A492 HydrophobicContact CG-CB 4.4Å; F480-A492 HydrophobicContact CZ-CB 4.18Å; F480-L495 HydrophobicContact CB-CB 4.24Å; F480-L495 HydrophobicContact CB-CD2 3.79Å
481	G	49.8	Very low	53.7	Low	39 Å²	39	105.8 Å²	105.8	40%	0.402	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-64.7	147.4	171.7	0	0	0	0	0	111.8	T479	T479-G481 PolarHBondContact O-N 3.14Å
482	C	63.7	Low	55.1	Low	14 Å²	14	99.1 Å²	99.1	10%	0.095	53%	0.533	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	133.2	166.1	-170	0	0	0	0	110	L484 Q487 L495 H498	C482-L484 PolarHBondContact O-N 3.45Å; C482-L484 PolarHBondContact SG-N 3.28Å; C482-Q487 PolarHBondContact N-O 2.92Å; C482-L495 HydrophobicContact CB-CD1 3.91Å; C482-H498 WeakPolarHBondContact CB-NE2 3.48Å; C482-H498 PolarHBondContact SG-NE2 2.96Å; C482-H498 VanDerWaalsContact SG-NE2 3.43Å
483	P	57.7	Low	56.6	Low	102 Å²	102	96.7 Å²	96.7	66%	0.662	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-2.8	174	29.4	-35	0	0	0	113.7	M499	P483-M499 HydrophobicContact CG-CE 3.64Å; P483-M499 HydrophobicContact CG-SD 4.17Å
484	L	57	Low	58.3	Low	108 Å²	108	94.4 Å²	94.4	57%	0.565	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.4	-7.1	-174.5	-58.7	175.8	0	0	0	114.3	C482 M499 H502	C482-L484 PolarHBondContact O-N 3.45Å; C482-L484 PolarHBondContact SG-N 3.28Å; L484-M499 HydrophobicContact CD1-CE 3.87Å; L484-M499 HydrophobicContact CG-CE 4.26Å; L484-H502 HydrophobicContact CD1-CB 3.62Å; L484-H502 PolarHBondContact O-CE1 2.88Å
485	C	65.1	Low	59.4	Low	37 Å²	37	87.4 Å²	87.4	25%	0.25	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	163.4	171.7	82.7	0	0	0	0	111.4	Q487 H498 H502	C485-Q487 PolarHBondContact O-N 3.12Å; C485-Q487 VanDerWaalsContact SG-CG 3.56Å; C485-H498 PolarHBondContact SG-CE1 3.02Å; C485-H498 PolarHBondContact SG-NE2 2.91Å; C485-H502 PolarHBondContact SG-NE2 3.32Å
486	P	61.1	Low	61	Low	127 Å²	127	89.7 Å²	89.7	83%	0.825	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72	13.9	-175	30.3	-36.9	0	0	0	115.3
487	Q	58.3	Low	62.3	Low	107 Å²	107	85.5 Å²	85.5	50%	0.5	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	129.6	177.7	-67.2	-66	-46.8	0	0	111.4	C482 C485 F489	C482-Q487 PolarHBondContact N-O 2.92Å; C485-Q487 PolarHBondContact O-N 3.12Å; C485-Q487 VanDerWaalsContact SG-CG 3.56Å; Q487-F489 HydrophobicContact CB-CE2 3.48Å; Q487-F489 VanDerWaalsContact CB-CE2 3.48Å; Q487-F489 HydrophobicContact CB-CZ 3.62Å; Q487-F489 HydrophobicContact CG-CZ 4.48Å
488	T	59.6	Low	63.4	Low	67 Å²	67	80.1 Å²	80.1	41%	0.411	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.7	178.7	48.7	0	0	0	0	111.2	T479	T479-T488 HydrophobicContact CG2-CG2 4.38Å
489	F	75.5	Confident	63.7	Low	36 Å²	36	73 Å²	73	16%	0.158	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131.1	-174	-61.1	-86.8	0	0	0	111.3	F480 Q487 V491 N494 L495 H498	F480-F489 WeakPolarHBondContact CB-O 3.48Å; F480-F489 WeakPolarHBondContact CD2-O 3.26Å; F480-F489 PolarHBondContact N-O 2.93Å; F480-F489 PolarHBondContact O-N 3.34Å; Q487-F489 HydrophobicContact CB-CE2 3.48Å; Q487-F489 VanDerWaalsContact CB-CE2 3.48Å; Q487-F489 HydrophobicContact CB-CZ 3.62Å; Q487-F489 HydrophobicContact CG-CZ 4.48Å; F489-V491 PolarHBondContact O-N 3.25Å; F489-N494 HydrophobicContact CB-CB 4.38Å; F489-N494 HydrophobicContact CD1-CB 3.9Å; F489-N494 HydrophobicContact CG-CB 4.46Å; F489-L495 HydrophobicContact CB-CB 4.13Å; F489-L495 HydrophobicContact CD2-CB 4.21Å; F489-L495 HydrophobicContact CD2-CD1 3.91Å; F489-L495 HydrophobicContact CE2-CD1 4.33Å; F489-L495 HydrophobicContact CG-CB 4.3Å; F489-H498 HydrophobicContact CD2-CB 4.5Å; F489-H498 HydrophobicContact CE1-CB 3.86Å; F489-H498 HydrophobicContact CE2-CB 3.79Å; F489-H498 AromaticContact CE2-CD2 3.13Å; F489-H498 WeakPolarHBondContact CE2-CD2 3.42Å; F489-H498 AromaticContact CE2-CG 3.42Å; F489-H498 VanDerWaalsContact CE2-CG 3.42Å; F489-H498 AromaticContact CE2-NE2 3.75Å; F489-H498 HydrophobicContact CZ-CB 3.42Å; F489-H498 VanDerWaalsContact CZ-CB 3.42Å; F489-H498 AromaticContact CZ-CD2 3.44Å; F489-H498 VanDerWaalsContact CZ-CD2 3.44Å; F489-H498 WeakPolarHBondContact CZ-CD2 3.15Å; F489-H498 AromaticContact CZ-CG 3.19Å; F489-H498 AromaticContact CZ-ND1 3.7Å
490	Y	67.3	Low	64.5	Low	160 Å²	160	73 Å²	73	63%	0.627	40%	0.402	S	S	*	.	S	Bend	trans	-79.8	3.5	176.8	-51.7	-72.9	0	0	0	113.7	K477 T479	K477-Y490 HydrophobicContact CB-CD1 4.46Å; K477-Y490 HydrophobicContact CB-CE1 4.46Å; T479-Y490 HydrophobicContact CG2-CD1 3.97Å; T479-Y490 HydrophobicContact CG2-CE1 3.54Å
491	V	78.9	Confident	65	Low	65 Å²	65	74.6 Å²	74.6	39%	0.394	41%	0.409	S	S	.	.	S	Bend	trans	-146.5	124.3	-178	-171	0	0	0	0	110	F489 A493 N494 L495	F489-V491 PolarHBondContact O-N 3.25Å; V491-A493 HydrophobicContact CG1-CB 4.04Å; V491-A493 PolarHBondContact O-N 3.09Å; V491-A493 VanDerWaalsContact O-N 3.1Å; V491-N494 HydrophobicContact CB-CB 4.32Å; V491-N494 WeakPolarHBondContact O-CA 3.44Å; V491-N494 WeakPolarHBondContact O-CB 3.41Å; V491-N494 PolarHBondContact O-N 3.21Å; V491-L495 PolarHBondContact O-N 3.31Å
492	A	59.4	Low	65.9	Low	34 Å²	34	74.9 Å²	74.9	28%	0.281	40%	0.4	S	S	.	.	H	α-helix	trans	-66.5	-10	-179.6	0	0	0	0	0	115.2	F480 R496	F480-A492 HydrophobicContact CD1-CB 4.35Å; F480-A492 HydrophobicContact CD2-CB 4.33Å; F480-A492 HydrophobicContact CE1-CB 4.24Å; F480-A492 HydrophobicContact CE2-CB 4.23Å; F480-A492 HydrophobicContact CG-CB 4.4Å; F480-A492 HydrophobicContact CZ-CB 4.18Å; A492-R496 PolarHBondContact O-N 3.34Å; A492-R496 PolarHBondContact O-NE 3.09Å
493	A	68.1	Low	66	Low	60 Å²	60	78.6 Å²	78.6	50%	0.496	42%	0.416	S	S	.	.	H	α-helix	trans	-78.5	-37	166.5	0	0	0	0	0	111.6	V491 R496 A497	V491-A493 HydrophobicContact CG1-CB 4.04Å; V491-A493 PolarHBondContact O-N 3.09Å; V491-A493 VanDerWaalsContact O-N 3.1Å; A493-R496 PolarHBondContact O-N 3.17Å; A493-A497 WeakPolarHBondContact O-CB 3.43Å; A493-A497 PolarHBondContact O-N 3.45Å
494	N	65.4	Low	66.1	Low	89 Å²	89	76.8 Å²	76.8	48%	0.476	40%	0.401	S	S	.	.	H	α-helix	trans	-72.8	-38.6	175.4	-63	11.7	0	0	0	110.6	F489 V491 R496 A497 H498	F489-N494 HydrophobicContact CB-CB 4.38Å; F489-N494 HydrophobicContact CD1-CB 3.9Å; F489-N494 HydrophobicContact CG-CB 4.46Å; V491-N494 HydrophobicContact CB-CB 4.32Å; V491-N494 WeakPolarHBondContact O-CA 3.44Å; V491-N494 WeakPolarHBondContact O-CB 3.41Å; V491-N494 PolarHBondContact O-N 3.21Å; N494-R496 VanDerWaalsContact C-N 3.35Å; N494-R496 PolarHBondContact O-N 3.17Å; N494-A497 PolarHBondContact O-N 3.01Å; N494-H498 VanDerWaalsContact O-CB 3.28Å; N494-H498 WeakPolarHBondContact O-CB 3.3Å; N494-H498 PolarHBondContact O-N 3.44Å
495	L	64.7	Low	66	Low	27 Å²	27	76 Å²	76	14%	0.141	39%	0.394	C	S	.	.	H	α-helix	trans	-59.3	-45.1	169.6	175.8	59.3	0	0	0	110.9	F480 C482 F489 V491 A497 H498 M499	F480-L495 HydrophobicContact CB-CB 4.24Å; F480-L495 HydrophobicContact CB-CD2 3.79Å; C482-L495 HydrophobicContact CB-CD1 3.91Å; F489-L495 HydrophobicContact CB-CB 4.13Å; F489-L495 HydrophobicContact CD2-CB 4.21Å; F489-L495 HydrophobicContact CD2-CD1 3.91Å; F489-L495 HydrophobicContact CE2-CD1 4.33Å; F489-L495 HydrophobicContact CG-CB 4.3Å; V491-L495 PolarHBondContact O-N 3.31Å; L495-A497 PolarHBondContact O-N 2.79Å; L495-H498 CarbonylContact O-C 3.55Å; L495-H498 PolarHBondContact O-N 3.03Å; L495-H498 VanDerWaalsContact O-N 3.12Å; L495-M499 HydrophobicContact CD1-CG 3.71Å; L495-M499 HydrophobicContact CD1-SD 4.22Å; L495-M499 HydrophobicContact CG-CG 4.19Å; L495-M499 HydrophobicContact CG-SD 4.45Å; L495-M499 WeakPolarHBondContact O-CG 3.18Å; L495-M499 PolarHBondContact O-N 3.38Å
496	R	66.8	Low	65.2	Low	167 Å²	167	81.4 Å²	81.4	63%	0.63	41%	0.41	S	S	*	.	H	α-helix	trans	-62.5	-42.3	175.8	-99	176.6	-74.1	-163	-8	113.2	A492 A493 N494 H498 M499 Q500	A492-R496 PolarHBondContact O-N 3.34Å; A492-R496 PolarHBondContact O-NE 3.09Å; A493-R496 PolarHBondContact O-N 3.17Å; N494-R496 VanDerWaalsContact C-N 3.35Å; N494-R496 PolarHBondContact O-N 3.17Å; R496-H498 PolarHBondContact O-N 2.84Å; R496-M499 PolarHBondContact O-N 3.32Å; R496-Q500 WeakPolarHBondContact O-CG 3.48Å; R496-Q500 PolarHBondContact O-N 3.31Å; R496-Q500 VanDerWaalsContact O-N 3.13Å; R496-Q500 PolarHBondContact O-NE2 3.26Å
497	A	73.3	Confident	64.9	Low	47 Å²	47	79 Å²	79	39%	0.388	39%	0.388	S	S	.	.	H	α-helix	trans	-64	-30.7	173.8	0	0	0	0	0	112.3	A493 N494 L495 F501	A493-A497 WeakPolarHBondContact O-CB 3.43Å; A493-A497 PolarHBondContact O-N 3.45Å; N494-A497 PolarHBondContact O-N 3.01Å; L495-A497 PolarHBondContact O-N 2.79Å; A497-F501 WeakPolarHBondContact O-CD2 3.38Å; A497-F501 WeakPolarHBondContact O-CE2 3.19Å
498	H	70.9	Confident	64.5	Low	28 Å²	28	78.2 Å²	78.2	13%	0.13	38%	0.383	C	S	.	.	H	α-helix	trans	-78.3	-41.6	176	168.3	64	0	0	0	113.2	C482 C485 F489 N494 L495 R496 Q500 F501 H502	C482-H498 WeakPolarHBondContact CB-NE2 3.48Å; C482-H498 PolarHBondContact SG-NE2 2.96Å; C482-H498 VanDerWaalsContact SG-NE2 3.43Å; C485-H498 PolarHBondContact SG-CE1 3.02Å; C485-H498 PolarHBondContact SG-NE2 2.91Å; F489-H498 HydrophobicContact CD2-CB 4.5Å; F489-H498 HydrophobicContact CE1-CB 3.86Å; F489-H498 HydrophobicContact CE2-CB 3.79Å; F489-H498 AromaticContact CE2-CD2 3.13Å; F489-H498 WeakPolarHBondContact CE2-CD2 3.42Å; F489-H498 AromaticContact CE2-CG 3.42Å; F489-H498 VanDerWaalsContact CE2-CG 3.42Å; F489-H498 AromaticContact CE2-NE2 3.75Å; F489-H498 HydrophobicContact CZ-CB 3.42Å; F489-H498 VanDerWaalsContact CZ-CB 3.42Å; F489-H498 AromaticContact CZ-CD2 3.44Å; F489-H498 VanDerWaalsContact CZ-CD2 3.44Å; F489-H498 WeakPolarHBondContact CZ-CD2 3.15Å; F489-H498 AromaticContact CZ-CG 3.19Å; F489-H498 AromaticContact CZ-ND1 3.7Å; N494-H498 VanDerWaalsContact O-CB 3.28Å; N494-H498 WeakPolarHBondContact O-CB 3.3Å; N494-H498 PolarHBondContact O-N 3.44Å; L495-H498 CarbonylContact O-C 3.55Å; L495-H498 PolarHBondContact O-N 3.03Å; L495-H498 VanDerWaalsContact O-N 3.12Å; R496-H498 PolarHBondContact O-N 2.84Å; H498-Q500 PolarHBondContact O-N 2.89Å; H498-F501 WeakPolarHBondContact O-CA 3.38Å; H498-F501 WeakPolarHBondContact O-CB 3.42Å; H498-F501 PolarHBondContact O-N 3.46Å; H498-H502 AromaticContact CE1-CD2 3.74Å; H498-H502 AromaticContact CE1-NE2 3.48Å; H498-H502 PolarHBondContact CE1-NE2 3.16Å; H498-H502 AromaticContact NE2-CD2 3.59Å; H498-H502 AromaticContact NE2-NE2 3.4Å; H498-H502 PolarHBondContact NE2-NE2 3.29Å; H498-H502 PolarHBondContact O-N 3.47Å
499	M	59.2	Low	63.5	Low	54 Å²	54	80.8 Å²	80.8	27%	0.266	39%	0.39	S	S	.	.	H	α-helix	trans	-63.2	-24.2	173.5	-67.7	-154.3	74.6	0	0	111.9	P483 L484 L495 R496 F501 H502 E503	P483-M499 HydrophobicContact CG-CE 3.64Å; P483-M499 HydrophobicContact CG-SD 4.17Å; L484-M499 HydrophobicContact CD1-CE 3.87Å; L484-M499 HydrophobicContact CG-CE 4.26Å; L495-M499 HydrophobicContact CD1-CG 3.71Å; L495-M499 HydrophobicContact CD1-SD 4.22Å; L495-M499 HydrophobicContact CG-CG 4.19Å; L495-M499 HydrophobicContact CG-SD 4.45Å; L495-M499 WeakPolarHBondContact O-CG 3.18Å; L495-M499 PolarHBondContact O-N 3.38Å; R496-M499 PolarHBondContact O-N 3.32Å; M499-F501 VanDerWaalsContact C-N 3.28Å; M499-F501 PolarHBondContact O-N 3.32Å; M499-H502 CarbonylContact O-C 3.5Å; M499-H502 WeakPolarHBondContact O-CA 3.31Å; M499-H502 WeakPolarHBondContact O-CB 3.49Å; M499-H502 PolarHBondContact O-N 3.44Å; M499-E503 WeakPolarHBondContact O-CG 3.3Å; M499-E503 PolarHBondContact O-N 2.8Å
500	Q	71.7	Confident	61.8	Low	66 Å²	66	83.4 Å²	83.4	31%	0.308	40%	0.403	S	S	.	.	H	α-helix	trans	-66.9	-24.3	168.8	-70.7	162.9	16.9	0	0	113.3	R496 H498 E503 D504	R496-Q500 WeakPolarHBondContact O-CG 3.48Å; R496-Q500 PolarHBondContact O-N 3.31Å; R496-Q500 VanDerWaalsContact O-N 3.13Å; R496-Q500 PolarHBondContact O-NE2 3.26Å; H498-Q500 PolarHBondContact O-N 2.89Å; Q500-E503 WeakPolarHBondContact CG-OE2 3.32Å; Q500-D504 VanDerWaalsContact O-CB 3.28Å; Q500-D504 WeakPolarHBondContact O-CB 3.49Å; Q500-D504 PolarHBondContact O-N 2.97Å
501	F	71.3	Confident	60.8	Low	133 Å²	133	81.7 Å²	81.7	58%	0.583	40%	0.395	S	S	*	.	H	α-helix	trans	-72.5	-32.9	165.9	-68.4	-99.9	0	0	0	111.3	A497 H498 M499 D504 E505	A497-F501 WeakPolarHBondContact O-CD2 3.38Å; A497-F501 WeakPolarHBondContact O-CE2 3.19Å; H498-F501 WeakPolarHBondContact O-CA 3.38Å; H498-F501 WeakPolarHBondContact O-CB 3.42Å; H498-F501 PolarHBondContact O-N 3.46Å; M499-F501 VanDerWaalsContact C-N 3.28Å; M499-F501 PolarHBondContact O-N 3.32Å; F501-D504 PolarHBondContact O-N 2.88Å; F501-E505 VanDerWaalsContact O-CB 3.29Å; F501-E505 WeakPolarHBondContact O-CB 3.48Å; F501-E505 VanDerWaalsContact O-CG 3.23Å; F501-E505 WeakPolarHBondContact O-CG 3.34Å; F501-E505 PolarHBondContact O-N 3.22Å
502	H	68.3	Low	58.9	Low	45 Å²	45	84 Å²	84	21%	0.208	41%	0.405	C	S	.	.	H	α-helix	trans	-70.1	-36.9	171.8	-75.4	-78	0	0	0	112.3	L484 C485 H498 M499 Y506	L484-H502 HydrophobicContact CD1-CB 3.62Å; L484-H502 PolarHBondContact O-CE1 2.88Å; C485-H502 PolarHBondContact SG-NE2 3.32Å; H498-H502 AromaticContact CE1-CD2 3.74Å; H498-H502 AromaticContact CE1-NE2 3.48Å; H498-H502 PolarHBondContact CE1-NE2 3.16Å; H498-H502 AromaticContact NE2-CD2 3.59Å; H498-H502 AromaticContact NE2-NE2 3.4Å; H498-H502 PolarHBondContact NE2-NE2 3.29Å; H498-H502 PolarHBondContact O-N 3.47Å; M499-H502 CarbonylContact O-C 3.5Å; M499-H502 WeakPolarHBondContact O-CA 3.31Å; M499-H502 WeakPolarHBondContact O-CB 3.49Å; M499-H502 PolarHBondContact O-N 3.44Å; H502-Y506 WeakPolarHBondContact O-CB 3.35Å; H502-Y506 PolarHBondContact O-N 3.32Å
503	E	66.1	Low	57.8	Low	92 Å²	92	87.7 Å²	87.7	43%	0.43	42%	0.419	S	S	.	.	H	α-helix	trans	-58.5	-50.4	167.4	-66.4	166.7	-164.5	0	0	110.6	M499 Q500 Y506 E507 R595	M499-E503 WeakPolarHBondContact O-CG 3.3Å; M499-E503 PolarHBondContact O-N 2.8Å; Q500-E503 WeakPolarHBondContact CG-OE2 3.32Å; E503-Y506 PolarHBondContact O-N 2.94Å; E503-E507 WeakPolarHBondContact O-CB 3.49Å; E503-E507 PolarHBondContact O-N 3.45Å; E503-R595 IonicContact OE2-CZ 3.33Å; E503-R595 IonicContact OE2-NH1 3.99Å; E503-R595 PolarHBondContact OE2-NH1 3.12Å; E503-R595 IonicContact OE2-NH2 3.56Å; E503-R595 PolarHBondContact OE2-NH2 3.41Å
504	D	61.2	Low	56.3	Low	64 Å²	64	91.8 Å²	91.8	34%	0.342	43%	0.428	S	S	.	.	H	α-helix	trans	-70.9	-30.1	-177.5	-71.6	-2.6	0	0	0	113.3	Q500 F501 K508 R595	Q500-D504 VanDerWaalsContact O-CB 3.28Å; Q500-D504 WeakPolarHBondContact O-CB 3.49Å; Q500-D504 PolarHBondContact O-N 2.97Å; F501-D504 PolarHBondContact O-N 2.88Å; D504-K508 WeakPolarHBondContact O-CD 3.19Å; D504-K508 WeakPolarHBondContact O-CE 3.29Å; D504-K508 WeakPolarHBondContact O-CG 3.33Å; D504-K508 PolarHBondContact O-N 3.48Å; D504-R595 IonicContact OD1-NH2 3.64Å
505	E	53.8	Low	55	Low	90 Å²	90	97.1 Å²	97.1	42%	0.421	44%	0.443	S	S	.	.	H	α-helix	trans	-76.9	-37.8	172	-70.5	-60.3	117.7	0	0	111.4	F501 K508 Q509	F501-E505 VanDerWaalsContact O-CB 3.29Å; F501-E505 WeakPolarHBondContact O-CB 3.48Å; F501-E505 VanDerWaalsContact O-CG 3.23Å; F501-E505 WeakPolarHBondContact O-CG 3.34Å; F501-E505 PolarHBondContact O-N 3.22Å; E505-K508 CarbonylContact O-C 3.57Å; E505-K508 WeakPolarHBondContact O-CA 3.43Å; E505-K508 WeakPolarHBondContact O-CB 3.17Å; E505-K508 PolarHBondContact O-N 2.85Å; E505-K508 IonicContact OE1-NZ 3.76Å; E505-K508 PolarHBondContact OE1-NZ 3.24Å; E505-Q509 PolarHBondContact O-N 3.28Å
506	Y	47.3	Very low	53.4	Low	151 Å²	151	103.7 Å²	103.7	59%	0.592	47%	0.473	S	S	*	.	H	α-helix	trans	-63.8	-45.3	172.9	-167.5	-94.8	0	0	0	110.7	H502 E503 K508 Q509 E510	H502-Y506 WeakPolarHBondContact O-CB 3.35Å; H502-Y506 PolarHBondContact O-N 3.32Å; E503-Y506 PolarHBondContact O-N 2.94Å; Y506-K508 PolarHBondContact O-N 3.14Å; Y506-Q509 PolarHBondContact O-N 2.86Å; Y506-Q509 VanDerWaalsContact O-N 3.1Å; Y506-E510 HydrophobicContact CD1-CG 3.98Å; Y506-E510 VanDerWaalsContact CE1-CD 3.49Å; Y506-E510 HydrophobicContact CE1-CG 3.79Å; Y506-E510 WeakPolarHBondContact CE1-OE1 3.17Å; Y506-E510 PolarHBondContact O-N 3.35Å
507	E	56.2	Low	51.7	Low	76 Å²	76	100.8 Å²	100.8	36%	0.355	47%	0.473	S	S	.	.	H	α-helix	trans	-58.7	-28	170.6	-82.9	-155.7	147.5	0	0	112.7	E503 R511	E503-E507 WeakPolarHBondContact O-CB 3.49Å; E503-E507 PolarHBondContact O-N 3.45Å; E507-R511 VanDerWaalsContact O-CB 3.26Å; E507-R511 WeakPolarHBondContact O-CB 3.49Å; E507-R511 VanDerWaalsContact O-CD 3.31Å; E507-R511 WeakPolarHBondContact O-CD 3.49Å; E507-R511 WeakPolarHBondContact O-CG 3.36Å; E507-R511 PolarHBondContact O-N 3.29Å; E507-R511 IonicContact OE1-NH2 3.94Å; E507-R511 PolarHBondContact OE1-NH2 3.2Å; E507-R511 VanDerWaalsContact OE1-NH2 3.1Å; E507-R511 IonicContact OE2-CZ 2.69Å; E507-R511 IonicContact OE2-NH1 2.66Å; E507-R511 PolarHBondContact OE2-NH1 3.44Å; E507-R511 IonicContact OE2-NH2 3.97Å; E507-R511 PolarHBondContact OE2-NH2 3.1Å
508	K	49	Very low	49.5	Very low	91 Å²	91	104.3 Å²	104.3	40%	0.396	49%	0.49	S	S	.	.	H	α-helix	trans	-77.8	-39.1	174.3	-74.2	162.7	-149.3	160	0	111.8	D504 E505 Y506 R511 L512	D504-K508 WeakPolarHBondContact O-CD 3.19Å; D504-K508 WeakPolarHBondContact O-CE 3.29Å; D504-K508 WeakPolarHBondContact O-CG 3.33Å; D504-K508 PolarHBondContact O-N 3.48Å; E505-K508 CarbonylContact O-C 3.57Å; E505-K508 WeakPolarHBondContact O-CA 3.43Å; E505-K508 WeakPolarHBondContact O-CB 3.17Å; E505-K508 PolarHBondContact O-N 2.85Å; E505-K508 IonicContact OE1-NZ 3.76Å; E505-K508 PolarHBondContact OE1-NZ 3.24Å; Y506-K508 PolarHBondContact O-N 3.14Å; K508-R511 PolarHBondContact O-N 2.88Å; K508-L512 WeakPolarHBondContact O-CB 3.25Å; K508-L512 VanDerWaalsContact O-CG 3.27Å; K508-L512 WeakPolarHBondContact O-CG 3.24Å; K508-L512 PolarHBondContact O-N 3.08Å
509	Q	38.9	Very low	47.7	Very low	121 Å²	121	108.1 Å²	108.1	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-68.8	-40.3	175.1	-75	179.1	-99.6	0	0	111.2	E505 Y506 L512 L513	E505-Q509 PolarHBondContact O-N 3.28Å; Y506-Q509 PolarHBondContact O-N 2.86Å; Y506-Q509 VanDerWaalsContact O-N 3.1Å; Q509-L512 PolarHBondContact O-N 3.18Å; Q509-L513 WeakPolarHBondContact O-CB 3.32Å; Q509-L513 VanDerWaalsContact O-CG 3.27Å; Q509-L513 WeakPolarHBondContact O-CG 3.37Å; Q509-L513 PolarHBondContact O-N 2.81Å
510	E	40.1	Very low	46	Very low	91 Å²	91	113.5 Å²	113.5	43%	0.425	55%	0.547	S	S	.	.	H	α-helix	trans	-58.5	-48.1	167.8	-73.9	-171.9	134.7	0	0	111.3	Y506 L512 L513 Q514	Y506-E510 HydrophobicContact CD1-CG 3.98Å; Y506-E510 VanDerWaalsContact CE1-CD 3.49Å; Y506-E510 HydrophobicContact CE1-CG 3.79Å; Y506-E510 WeakPolarHBondContact CE1-OE1 3.17Å; Y506-E510 PolarHBondContact O-N 3.35Å; E510-L512 VanDerWaalsContact C-N 3.31Å; E510-L512 PolarHBondContact O-N 2.99Å; E510-L513 PolarHBondContact O-N 3.4Å; E510-Q514 WeakPolarHBondContact O-CB 3.44Å; E510-Q514 PolarHBondContact O-N 2.87Å
511	R	45.3	Very low	44.5	Very low	124 Å²	124	119.9 Å²	119.9	47%	0.468	57%	0.574	S	S	.	*	H	α-helix	trans	-64.4	-30.7	176.9	-76.2	169	-170.2	130.6	11.6	113.8	E507 K508 Y515	E507-R511 VanDerWaalsContact O-CB 3.26Å; E507-R511 WeakPolarHBondContact O-CB 3.49Å; E507-R511 VanDerWaalsContact O-CD 3.31Å; E507-R511 WeakPolarHBondContact O-CD 3.49Å; E507-R511 WeakPolarHBondContact O-CG 3.36Å; E507-R511 PolarHBondContact O-N 3.29Å; E507-R511 IonicContact OE1-NH2 3.94Å; E507-R511 PolarHBondContact OE1-NH2 3.2Å; E507-R511 VanDerWaalsContact OE1-NH2 3.1Å; E507-R511 IonicContact OE2-CZ 2.69Å; E507-R511 IonicContact OE2-NH1 2.66Å; E507-R511 PolarHBondContact OE2-NH1 3.44Å; E507-R511 IonicContact OE2-NH2 3.97Å; E507-R511 PolarHBondContact OE2-NH2 3.1Å; K508-R511 PolarHBondContact O-N 2.88Å; R511-Y515 WeakPolarHBondContact O-CB 2.99Å; R511-Y515 PolarHBondContact O-N 3.27Å
512	L	40.1	Very low	42.5	Very low	115 Å²	115	120.9 Å²	120.9	60%	0.602	58%	0.58	S	S	*	*	H	α-helix	trans	-74.1	-40	174.6	-78.7	165	0	0	0	111.6	K508 Q509 E510 Q514 Y515 Q516	K508-L512 WeakPolarHBondContact O-CB 3.25Å; K508-L512 VanDerWaalsContact O-CG 3.27Å; K508-L512 WeakPolarHBondContact O-CG 3.24Å; K508-L512 PolarHBondContact O-N 3.08Å; Q509-L512 PolarHBondContact O-N 3.18Å; E510-L512 VanDerWaalsContact C-N 3.31Å; E510-L512 PolarHBondContact O-N 2.99Å; L512-Q514 VanDerWaalsContact C-N 3.32Å; L512-Y515 CarbonylContact O-C 3.56Å; L512-Y515 PolarHBondContact O-N 3.19Å; L512-Y515 VanDerWaalsContact O-N 3.12Å; L512-Q516 PolarHBondContact O-N 3.47Å
513	L	36.8	Very low	40.5	Very low	110 Å²	110	128.2 Å²	128.2	58%	0.576	61%	0.606	S	S	*	*	H	α-helix	trans	-61.5	-42.4	169.3	-70.4	165.6	0	0	0	110.6	Q509 E510 Y515 Q516 V517	Q509-L513 WeakPolarHBondContact O-CB 3.32Å; Q509-L513 VanDerWaalsContact O-CG 3.27Å; Q509-L513 WeakPolarHBondContact O-CG 3.37Å; Q509-L513 PolarHBondContact O-N 2.81Å; E510-L513 PolarHBondContact O-N 3.4Å; L513-Y515 PolarHBondContact O-N 3.15Å; L513-Q516 PolarHBondContact O-N 3.27Å; L513-Q516 VanDerWaalsContact O-N 3.08Å; L513-V517 PolarHBondContact O-N 2.78Å; L513-V517 VanDerWaalsContact O-N 3.07Å
514	Q	36.9	Very low	39.2	Very low	147 Å²	147	131 Å²	131	69%	0.687	62%	0.619	S	S	*	*	H	α-helix	trans	-63.8	-25	174	-141.8	101.9	72.9	0	0	113	E510 L512	E510-Q514 WeakPolarHBondContact O-CB 3.44Å; E510-Q514 PolarHBondContact O-N 2.87Å; L512-Q514 VanDerWaalsContact C-N 3.32Å
515	Y	36.3	Very low	38.8	Very low	200 Å²	200	136.8 Å²	136.8	78%	0.784	64%	0.641	S	S	*	*	H	α-helix	trans	-89	-11.6	174.5	-119.9	-96.3	0	0	0	113.8	R511 L512 L513	R511-Y515 WeakPolarHBondContact O-CB 2.99Å; R511-Y515 PolarHBondContact O-N 3.27Å; L512-Y515 CarbonylContact O-C 3.56Å; L512-Y515 PolarHBondContact O-N 3.19Å; L512-Y515 VanDerWaalsContact O-N 3.12Å; L513-Y515 PolarHBondContact O-N 3.15Å
516	Q	31	Very low	38.6	Very low	165 Å²	165	134.5 Å²	134.5	77%	0.771	64%	0.642	S	S	*	*	H	α-helix	trans	-91.7	-17.9	168.1	-71.4	-171.1	-6.3	0	0	112.6	L512 L513 V518	L512-Q516 PolarHBondContact O-N 3.47Å; L513-Q516 PolarHBondContact O-N 3.27Å; L513-Q516 VanDerWaalsContact O-N 3.08Å; Q516-V518 PolarHBondContact O-N 2.91Å
517	V	32.2	Very low	39.6	Very low	106 Å²	106	130.5 Å²	130.5	64%	0.642	63%	0.628	S	S	*	*			trans	-95.4	74.4	170.7	-172.5	0	0	0	0	110.5	L513 P519	L513-V517 PolarHBondContact O-N 2.78Å; L513-V517 VanDerWaalsContact O-N 3.07Å; V517-P519 WeakPolarHBondContact O-CD 3.4Å
518	V	27.1	Very low	39.9	Very low	121 Å²	121	131.2 Å²	131.2	73%	0.733	64%	0.638	S	S	*	*			trans	-83.7	112.7	157.9	179.5	0	0	0	0	107.2	Q516 N520	Q516-V518 PolarHBondContact O-N 2.91Å; V518-N520 PolarHBondContact O-N 3.28Å
519	P	32.1	Very low	41.1	Very low	109 Å²	109	127.3 Å²	127.3	71%	0.708	62%	0.622	S	S	*	*			trans	-75.6	94.7	-175.1	30	-34.5	0	0	0	110.9	V517	V517-P519 WeakPolarHBondContact O-CD 3.4Å
520	N	25.3	Very low	42.3	Very low	166 Å²	166	126 Å²	126	89%	0.888	62%	0.624	S	S	*	*			trans	-62.8	137.6	160.3	-127.9	-5.5	0	0	0	108.3	V518	V518-N520 PolarHBondContact O-N 3.28Å
521	K	38.3	Very low	43.2	Very low	200 Å²	200	126.5 Å²	126.5	87%	0.87	63%	0.627	S	S	*	*			trans	-82.2	153.9	-171.5	-68.4	179.3	179	176.6	0	112.2
522	H	30	Very low	44.3	Very low	155 Å²	155	122.3 Å²	122.3	72%	0.718	62%	0.616	S	S	*	*			trans	95.1	131.9	160.7	-124.2	-34.9	0	0	0	118.4
523	W	26.3	Very low	45.6	Very low	198 Å²	198	123.3 Å²	123.3	75%	0.75	63%	0.629	S	S	*	*			trans	63.1	130.3	175.5	-90.4	-89.9	0	0	0	116.3
524	E	38.5	Very low	46.9	Very low	150 Å²	150	120.4 Å²	120.4	70%	0.701	62%	0.618	S	S	*	*			cis	-153	167	-13	-147.8	168.9	-146.7	0	0	110.3	G526	E524-G526 PolarHBondContact O-N 2.72Å
525	K	53.1	Low	48.5	Very low	186 Å²	186	117.9 Å²	117.9	81%	0.809	61%	0.612	S	S	*	*			trans	-86.4	92	-176.6	-69.9	-177.8	179.8	178.1	0	112.5
526	G	50.8	Low	50	Low	43 Å²	43	110.7 Å²	110.7	44%	0.443	59%	0.585	S	S	.	*			trans	-91.6	136.8	165.2	0	0	0	0	0	112.6	E524 F536	E524-G526 PolarHBondContact O-N 2.72Å; G526-F536 CarbonylContact C-O 3.3Å
527	H	67.3	Low	51.6	Low	66 Å²	66	112.4 Å²	112.4	31%	0.306	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.1	99.2	176	-64.2	85.3	0	0	0	110.1	F536 R537 E539 L542	H527-F536 PolarHBondContact N-O 3.39Å; H527-F536 PolarHBondContact O-N 3.37Å; H527-R537 PolarHBondContact ND1-O 3.34Å; H527-E539 PolarHBondContact ND1-N 2.69Å; H527-L542 HydrophobicContact CB-CB 4.08Å; H527-L542 HydrophobicContact CB-CD2 3.94Å
528	T	63.6	Low	53	Low	91 Å²	91	112.6 Å²	112.6	56%	0.558	58%	0.582	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78	135.2	-178.5	56.9	0	0	0	0	112	V535	T528-V535 HydrophobicContact CG2-CG1 3.96Å; T528-V535 HydrophobicContact CG2-CG2 3.98Å
529	C	72.8	Confident	54.7	Low	10 Å²	10	112 Å²	112	7%	0.068	57%	0.571	C	S	.	*			trans	-70.9	132.9	172.2	-175.8	0	0	0	0	111.5	H531 C532 S534 F536 L542 H545	C529-H531 PolarHBondContact O-N 3.4Å; C529-H531 PolarHBondContact SG-N 2.89Å; C529-C532 WeakPolarHBondContact CB-O 3.48Å; C529-S534 PolarHBondContact N-O 3.08Å; C529-F536 HydrophobicContact CB-CE2 4.32Å; C529-L542 HydrophobicContact CB-CD1 3.74Å; C529-H545 PolarHBondContact SG-NE2 3.18Å
530	P	64	Low	56.5	Low	93 Å²	93	111.4 Å²	111.4	60%	0.604	57%	0.568	S	S	*	*	S	Bend	trans	-69.6	-14.2	176.3	-21.2	33.8	0	0	0	114.9
531	H	59.9	Low	58.6	Low	102 Å²	102	105.1 Å²	105.1	47%	0.472	54%	0.542	S	S	.	.	S	Bend	trans	-118.9	-7.1	-168.1	-60.5	-58	0	0	0	114.7	C529	C529-H531 PolarHBondContact O-N 3.4Å; C529-H531 PolarHBondContact SG-N 2.89Å
532	C	67.3	Low	60.4	Low	36 Å²	36	96.5 Å²	96.5	24%	0.243	51%	0.505	C	S	.	.	S	Bend	trans	-154.2	159.5	170.4	70.6	0	0	0	0	109.7	C529 S534 H545	C529-C532 WeakPolarHBondContact CB-O 3.48Å; C532-S534 PolarHBondContact O-N 2.77Å; C532-S534 PolarHBondContact SG-OG 2.7Å; C532-H545 PolarHBondContact SG-CE1 3.43Å; C532-H545 PolarHBondContact SG-NE2 2.73Å
533	P	68.3	Low	62	Low	136 Å²	136	92.8 Å²	92.8	88%	0.883	49%	0.487	S	S	*	.	S	Bend	trans	-72.8	17.8	-175.2	30.4	-36.6	0	0	0	115
534	S	64.4	Low	64.2	Low	48 Å²	48	85 Å²	85	34%	0.336	47%	0.469	S	S	.	.			trans	-75.9	133.1	177.4	-61.3	0	0	0	0	111.8	C529 C532	C529-S534 PolarHBondContact N-O 3.08Å; C532-S534 PolarHBondContact O-N 2.77Å; C532-S534 PolarHBondContact SG-OG 2.7Å
535	V	69.1	Low	66	Low	94 Å²	94	78.9 Å²	78.9	57%	0.57	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.1	177.1	-167.7	0	0	0	0	109.1	T528	T528-V535 HydrophobicContact CG2-CG1 3.96Å; T528-V535 HydrophobicContact CG2-CG2 3.98Å
536	F	69.8	Low	66.8	Low	50 Å²	50	70.8 Å²	70.8	22%	0.219	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	146.5	179.9	-59.8	-85.1	0	0	0	109.2	G526 H527 C529 L542 H545	G526-F536 CarbonylContact C-O 3.3Å; H527-F536 PolarHBondContact N-O 3.39Å; H527-F536 PolarHBondContact O-N 3.37Å; C529-F536 HydrophobicContact CB-CE2 4.32Å; F536-L542 HydrophobicContact CB-CB 4.11Å; F536-L542 HydrophobicContact CD2-CB 3.92Å; F536-L542 HydrophobicContact CD2-CD1 3.86Å; F536-L542 HydrophobicContact CE2-CD1 4.17Å; F536-L542 HydrophobicContact CG-CB 4.18Å; F536-H545 HydrophobicContact CD1-CB 4.48Å; F536-H545 HydrophobicContact CD2-CB 4.49Å; F536-H545 HydrophobicContact CE1-CB 3.74Å; F536-H545 HydrophobicContact CE2-CB 3.74Å; F536-H545 AromaticContact CE2-CD2 3.48Å; F536-H545 VanDerWaalsContact CE2-CD2 3.48Å; F536-H545 WeakPolarHBondContact CE2-CD2 3.28Å; F536-H545 AromaticContact CE2-CG 3.5Å; F536-H545 HydrophobicContact CZ-CB 3.33Å; F536-H545 AromaticContact CZ-CD2 3.69Å; F536-H545 AromaticContact CZ-CG 3.21Å; F536-H545 AromaticContact CZ-ND1 3.54Å
537	R	63.3	Low	67.7	Low	200 Å²	200	72.8 Å²	72.8	76%	0.755	41%	0.405	S	S	*	.	S	Bend	trans	-67.8	-49.3	175.7	-66.2	-176.9	-178.5	-120.1	0.9	109.4	H527	H527-R537 PolarHBondContact ND1-O 3.34Å
538	D	62.3	Low	67.6	Low	111 Å²	111	73.1 Å²	73.1	59%	0.594	42%	0.415	S	S	*	.	S	Bend	trans	-112.1	147.2	-172.4	-45.9	-79	0	0	0	112.7	G541 L542	D538-G541 WeakPolarHBondContact O-CA 3.44Å; D538-G541 PolarHBondContact O-N 3.13Å; D538-L542 PolarHBondContact O-N 3.01Å
539	E	62.9	Low	67.6	Low	108 Å²	108	73.2 Å²	73.2	51%	0.505	42%	0.415	S	S	.	.	H	α-helix	trans	-58.8	-39.2	-179.2	-147	-107.8	132.1	0	0	113.3	H527 G541 L542 K543	H527-E539 PolarHBondContact ND1-N 2.69Å; E539-G541 PolarHBondContact O-N 3.49Å; E539-L542 PolarHBondContact O-N 3.08Å; E539-K543 WeakPolarHBondContact O-CB 3.37Å; E539-K543 PolarHBondContact O-N 3.38Å
540	P	69.8	Low	67.5	Low	97 Å²	97	74.5 Å²	74.5	63%	0.63	42%	0.42	S	S	*	.	H	α-helix	trans	-61.4	-29.4	171.4	-24.4	35.7	0	0	0	113.8	K543 G544	P540-K543 PolarHBondContact O-N 2.86Å; P540-G544 PolarHBondContact O-N 3.03Å
541	G	69.7	Low	67.2	Low	34 Å²	34	76.7 Å²	76.7	35%	0.351	42%	0.42	S	S	.	.	H	α-helix	trans	-69.4	-44.3	174.7	0	0	0	0	0	111.9	D538 E539 H545	D538-G541 WeakPolarHBondContact O-CA 3.44Å; D538-G541 PolarHBondContact O-N 3.13Å; E539-G541 PolarHBondContact O-N 3.49Å; G541-H545 WeakPolarHBondContact O-CB 3.31Å; G541-H545 PolarHBondContact O-N 2.96Å
542	L	74.5	Confident	66.9	Low	19 Å²	19	77 Å²	77	10%	0.099	43%	0.431	C	S	.	.	H	α-helix	trans	-61.1	-44.9	170.8	171.7	59.3	0	0	0	111.1	H527 C529 F536 D538 E539 H545 L546	H527-L542 HydrophobicContact CB-CB 4.08Å; H527-L542 HydrophobicContact CB-CD2 3.94Å; C529-L542 HydrophobicContact CB-CD1 3.74Å; F536-L542 HydrophobicContact CB-CB 4.11Å; F536-L542 HydrophobicContact CD2-CB 3.92Å; F536-L542 HydrophobicContact CD2-CD1 3.86Å; F536-L542 HydrophobicContact CE2-CD1 4.17Å; F536-L542 HydrophobicContact CG-CB 4.18Å; D538-L542 PolarHBondContact O-N 3.01Å; E539-L542 PolarHBondContact O-N 3.08Å; L542-H545 WeakPolarHBondContact O-CB 3.1Å; L542-H545 PolarHBondContact O-N 2.94Å; L542-L546 HydrophobicContact CD1-CD1 4.04Å; L542-L546 HydrophobicContact CD1-CG 4.04Å; L542-L546 HydrophobicContact CG-CD1 4.04Å; L542-L546 HydrophobicContact CG-CG 4.48Å; L542-L546 WeakPolarHBondContact O-CG 3.26Å; L542-L546 PolarHBondContact O-N 2.74Å
543	K	63.7	Low	66.3	Low	77 Å²	77	77.4 Å²	77.4	34%	0.335	43%	0.433	S	S	.	.	H	α-helix	trans	-66	-41.1	-178.8	-162.5	170.2	-177.5	178.7	0	112.1	E539 P540 L546 L547 E558	E539-K543 WeakPolarHBondContact O-CB 3.37Å; E539-K543 PolarHBondContact O-N 3.38Å; P540-K543 PolarHBondContact O-N 2.86Å; K543-L546 PolarHBondContact O-N 3.17Å; K543-L547 HydrophobicContact CG-CD1 4.17Å; K543-L547 WeakPolarHBondContact O-CB 3.5Å; K543-L547 WeakPolarHBondContact O-CG 3.45Å; K543-L547 PolarHBondContact O-N 3.1Å; K543-E558 VanDerWaalsContact CE-OE1 3.22Å; K543-E558 WeakPolarHBondContact CE-OE1 3.46Å; K543-E558 WeakPolarHBondContact CE-OE2 3.26Å; K543-E558 IonicContact NZ-OE1 2.77Å; K543-E558 PolarHBondContact NZ-OE1 2.72Å; K543-E558 IonicContact NZ-OE2 3.64Å
544	G	73	Confident	65.6	Low	35 Å²	35	71.1 Å²	71.1	36%	0.361	39%	0.392	S	S	.	.	H	α-helix	trans	-63.3	-37.3	171.6	0	0	0	0	0	113.2	P540 L547 S548	P540-G544 PolarHBondContact O-N 3.03Å; G544-L547 PolarHBondContact O-N 2.83Å; G544-S548 WeakPolarHBondContact O-CB 3.47Å; G544-S548 PolarHBondContact O-N 3.26Å; G544-S548 PolarHBondContact O-OG 3.49Å
545	H	77.1	Confident	65	Low	21 Å²	21	75.8 Å²	75.8	10%	0.097	41%	0.409	C	S	.	.	H	α-helix	trans	-65.4	-44.6	171.4	163.7	78	0	0	0	112.3	C529 C532 F536 G541 L542 L547 S548 V549 H550	C529-H545 PolarHBondContact SG-NE2 3.18Å; C532-H545 PolarHBondContact SG-CE1 3.43Å; C532-H545 PolarHBondContact SG-NE2 2.73Å; F536-H545 HydrophobicContact CD1-CB 4.48Å; F536-H545 HydrophobicContact CD2-CB 4.49Å; F536-H545 HydrophobicContact CE1-CB 3.74Å; F536-H545 HydrophobicContact CE2-CB 3.74Å; F536-H545 AromaticContact CE2-CD2 3.48Å; F536-H545 VanDerWaalsContact CE2-CD2 3.48Å; F536-H545 WeakPolarHBondContact CE2-CD2 3.28Å; F536-H545 AromaticContact CE2-CG 3.5Å; F536-H545 HydrophobicContact CZ-CB 3.33Å; F536-H545 AromaticContact CZ-CD2 3.69Å; F536-H545 AromaticContact CZ-CG 3.21Å; F536-H545 AromaticContact CZ-ND1 3.54Å; G541-H545 WeakPolarHBondContact O-CB 3.31Å; G541-H545 PolarHBondContact O-N 2.96Å; L542-H545 WeakPolarHBondContact O-CB 3.1Å; L542-H545 PolarHBondContact O-N 2.94Å; H545-L547 VanDerWaalsContact C-N 3.35Å; H545-L547 PolarHBondContact O-N 3.28Å; H545-S548 WeakPolarHBondContact CA-OG 3.4Å; H545-S548 PolarHBondContact O-N 2.89Å; H545-S548 PolarHBondContact O-OG 2.88Å; H545-V549 WeakPolarHBondContact ND1-CG2 3.42Å; H545-V549 WeakPolarHBondContact O-CB 3.13Å; H545-V549 PolarHBondContact O-N 2.82Å; H545-H550 AromaticContact NE2-CD2 3.45Å; H545-H550 PolarHBondContact NE2-CD2 3.24Å; H545-H550 AromaticContact NE2-NE2 3.56Å
546	L	69.3	Low	63.8	Low	15 Å²	15	79.5 Å²	79.5	8%	0.079	41%	0.414	C	S	.	.	H	α-helix	trans	-61.8	-42.3	174.7	-69.9	169.1	0	0	0	111.2	L542 K543 S548 H550 K551 A554 L557	L542-L546 HydrophobicContact CD1-CD1 4.04Å; L542-L546 HydrophobicContact CD1-CG 4.04Å; L542-L546 HydrophobicContact CG-CD1 4.04Å; L542-L546 HydrophobicContact CG-CG 4.48Å; L542-L546 WeakPolarHBondContact O-CG 3.26Å; L542-L546 PolarHBondContact O-N 2.74Å; K543-L546 PolarHBondContact O-N 3.17Å; L546-S548 VanDerWaalsContact C-N 3.27Å; L546-S548 PolarHBondContact O-N 3.17Å; L546-H550 HydrophobicContact CD2-CB 4.06Å; L546-H550 CarbonylContact O-C 3.54Å; L546-H550 VanDerWaalsContact O-CA 3.27Å; L546-H550 WeakPolarHBondContact O-CA 3.2Å; L546-H550 PolarHBondContact O-N 3.34Å; L546-K551 PolarHBondContact O-N 3.47Å; L546-A554 HydrophobicContact CB-CB 4.35Å; L546-L557 HydrophobicContact CD1-CD1 4.43Å
547	L	70.6	Confident	62.8	Low	86 Å²	86	81.1 Å²	81.1	45%	0.45	42%	0.424	S	S	.	.	H	α-helix	trans	-71	-13	176.8	-75.2	163.4	0	0	0	114.7	K543 G544 H545 K551 A554	K543-L547 HydrophobicContact CG-CD1 4.17Å; K543-L547 WeakPolarHBondContact O-CB 3.5Å; K543-L547 WeakPolarHBondContact O-CG 3.45Å; K543-L547 PolarHBondContact O-N 3.1Å; G544-L547 PolarHBondContact O-N 2.83Å; H545-L547 VanDerWaalsContact C-N 3.35Å; H545-L547 PolarHBondContact O-N 3.28Å; L547-K551 VanDerWaalsContact O-CE 3.25Å; L547-K551 WeakPolarHBondContact O-CE 3.32Å; L547-K551 WeakPolarHBondContact O-CG 3.34Å; L547-A554 HydrophobicContact CD2-CB 3.51Å; L547-A554 HydrophobicContact CG-CB 3.81Å
548	S	63.8	Low	61.8	Low	72 Å²	72	76.3 Å²	76.3	50%	0.503	41%	0.41	S	S	.	.	H	α-helix	trans	-108	-47.1	179.1	51.2	0	0	0	0	113	G544 H545 L546	G544-S548 WeakPolarHBondContact O-CB 3.47Å; G544-S548 PolarHBondContact O-N 3.26Å; G544-S548 PolarHBondContact O-OG 3.49Å; H545-S548 WeakPolarHBondContact CA-OG 3.4Å; H545-S548 PolarHBondContact O-N 2.89Å; H545-S548 PolarHBondContact O-OG 2.88Å; L546-S548 VanDerWaalsContact C-N 3.27Å; L546-S548 PolarHBondContact O-N 3.17Å
549	V	64.7	Low	60.8	Low	94 Å²	94	76.8 Å²	76.8	57%	0.57	42%	0.417	S	S	*	.	H	α-helix	trans	-94.5	-35.8	-175.5	-175.9	0	0	0	0	112.3	H545	H545-V549 WeakPolarHBondContact ND1-CG2 3.42Å; H545-V549 WeakPolarHBondContact O-CB 3.13Å; H545-V549 PolarHBondContact O-N 2.82Å
550	H	69.3	Low	59.8	Low	36 Å²	36	77.4 Å²	77.4	17%	0.167	42%	0.424	C	S	.	.	S	Bend	trans	-116	41.7	-176.1	-60.9	-71.1	0	0	0	112.2	H545 L546 P552 T553 A554	H545-H550 AromaticContact NE2-CD2 3.45Å; H545-H550 PolarHBondContact NE2-CD2 3.24Å; H545-H550 AromaticContact NE2-NE2 3.56Å; L546-H550 HydrophobicContact CD2-CB 4.06Å; L546-H550 CarbonylContact O-C 3.54Å; L546-H550 VanDerWaalsContact O-CA 3.27Å; L546-H550 WeakPolarHBondContact O-CA 3.2Å; L546-H550 PolarHBondContact O-N 3.34Å; H550-P552 VanDerWaalsContact C-CD 3.4Å; H550-P552 VanDerWaalsContact O-N 3.1Å; H550-T553 WeakPolarHBondContact O-CB 3.24Å; H550-T553 PolarHBondContact O-N 3.44Å; H550-A554 PolarHBondContact O-N 2.85Å
551	K	58.1	Low	58.4	Low	139 Å²	139	77.1 Å²	77.1	60%	0.604	43%	0.429	S	S	*	.	H	α-helix	trans	-42.5	-44.9	-172.7	-81.6	177.9	-180	-175.3	0	116.2	L546 L547 T553	L546-K551 PolarHBondContact O-N 3.47Å; L547-K551 VanDerWaalsContact O-CE 3.25Å; L547-K551 WeakPolarHBondContact O-CE 3.32Å; L547-K551 WeakPolarHBondContact O-CG 3.34Å; K551-T553 PolarHBondContact O-N 2.9Å
552	P	54.2	Low	56.7	Low	109 Å²	109	79.8 Å²	79.8	71%	0.708	45%	0.448	S	S	*	.	H	α-helix	trans	-64.3	-26.9	178.4	-22.1	34.5	0	0	0	114	H550	H550-P552 VanDerWaalsContact C-CD 3.4Å; H550-P552 VanDerWaalsContact O-N 3.1Å
553	T	55	Low	54.8	Low	44 Å²	44	85.2 Å²	85.2	27%	0.27	49%	0.485	S	S	.	.	H	α-helix	trans	-90.4	-26.7	-172.9	-43.7	0	0	0	0	112.6	H550 K551 Y556 L557	H550-T553 WeakPolarHBondContact O-CB 3.24Å; H550-T553 PolarHBondContact O-N 3.44Å; K551-T553 PolarHBondContact O-N 2.9Å; T553-Y556 WeakPolarHBondContact O-CB 3.32Å; T553-Y556 PolarHBondContact O-N 3.07Å; T553-L557 PolarHBondContact O-N 3.1Å
554	A	53.3	Low	53.7	Low	4 Å²	4	91.3 Å²	91.3	3%	0.033	51%	0.511	C	S	.	.	H	α-helix	trans	-63	-46.1	177.9	0	0	0	0	0	112.1	L546 L547 H550 Y556 L557 E558	L546-A554 HydrophobicContact CB-CB 4.35Å; L547-A554 HydrophobicContact CD2-CB 3.51Å; L547-A554 HydrophobicContact CG-CB 3.81Å; H550-A554 PolarHBondContact O-N 2.85Å; A554-Y556 PolarHBondContact O-N 3Å; A554-L557 PolarHBondContact O-N 2.99Å; A554-L557 VanDerWaalsContact O-N 3.09Å; A554-E558 PolarHBondContact O-N 3.44Å
555	Q	52.1	Low	51.7	Low	147 Å²	147	99.6 Å²	99.6	69%	0.687	54%	0.537	S	S	*	.	H	α-helix	trans	-58.2	-33.4	175.5	-70.9	-177.8	-34.6	0	0	112.8	T559	Q555-T559 PolarHBondContact O-N 3.23Å; Q555-T559 PolarHBondContact O-OG1 3.29Å
556	Y	43.9	Very low	49.5	Very low	171 Å²	171	108.1 Å²	108.1	67%	0.671	58%	0.577	S	S	*	*	H	α-helix	trans	-68	-35.4	177.7	-169.5	-98.9	0	0	0	112.7	T553 A554 L560	T553-Y556 WeakPolarHBondContact O-CB 3.32Å; T553-Y556 PolarHBondContact O-N 3.07Å; A554-Y556 PolarHBondContact O-N 3Å; Y556-L560 HydrophobicContact CD1-CD1 4.35Å; Y556-L560 HydrophobicContact CE1-CD1 4.13Å; Y556-L560 WeakPolarHBondContact O-CD1 3.2Å; Y556-L560 WeakPolarHBondContact O-CG 3.21Å
557	L	49.5	Very low	47.8	Very low	84 Å²	84	115 Å²	115	44%	0.44	61%	0.613	S	S	.	*	H	α-helix	trans	-83.2	-36	178.1	-69.3	170.8	0	0	0	112.9	L546 T553 A554 T559 L560	L546-L557 HydrophobicContact CD1-CD1 4.43Å; T553-L557 PolarHBondContact O-N 3.1Å; A554-L557 PolarHBondContact O-N 2.99Å; A554-L557 VanDerWaalsContact O-N 3.09Å; L557-T559 PolarHBondContact O-N 2.88Å; L557-L560 PolarHBondContact O-N 2.86Å; L557-L560 VanDerWaalsContact O-N 3.08Å
558	E	41.6	Very low	45.6	Very low	99 Å²	99	117.6 Å²	117.6	46%	0.463	63%	0.632	S	S	.	*	H	α-helix	trans	-55	-35.5	174.8	-147.6	73.4	-126.2	0	0	111.6	K543 A554 L560	K543-E558 VanDerWaalsContact CE-OE1 3.22Å; K543-E558 WeakPolarHBondContact CE-OE1 3.46Å; K543-E558 WeakPolarHBondContact CE-OE2 3.26Å; K543-E558 IonicContact NZ-OE1 2.77Å; K543-E558 PolarHBondContact NZ-OE1 2.72Å; K543-E558 IonicContact NZ-OE2 3.64Å; A554-E558 PolarHBondContact O-N 3.44Å; E558-L560 VanDerWaalsContact C-N 3.29Å; E558-L560 PolarHBondContact O-N 3.46Å
559	T	41.8	Very low	44.1	Very low	121 Å²	121	122.7 Å²	122.7	74%	0.742	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-12.1	-178.2	-51.5	0	0	0	0	113.8	Q555 L557	Q555-T559 PolarHBondContact O-N 3.23Å; Q555-T559 PolarHBondContact O-OG1 3.29Å; L557-T559 PolarHBondContact O-N 2.88Å
560	L	41.9	Very low	42.3	Very low	122 Å²	122	125.6 Å²	125.6	64%	0.639	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	3.4	-171.4	-67.8	172	0	0	0	114.6	Y556 L557 E558	Y556-L560 HydrophobicContact CD1-CD1 4.35Å; Y556-L560 HydrophobicContact CE1-CD1 4.13Å; Y556-L560 WeakPolarHBondContact O-CD1 3.2Å; Y556-L560 WeakPolarHBondContact O-CG 3.21Å; L557-L560 PolarHBondContact O-N 2.86Å; L557-L560 VanDerWaalsContact O-N 3.08Å; E558-L560 VanDerWaalsContact C-N 3.29Å; E558-L560 PolarHBondContact O-N 3.46Å
561	A	38.9	Very low	40.3	Very low	90 Å²	90	128.8 Å²	128.8	74%	0.744	69%	0.685	S	S	*	*			trans	-118.2	55.8	-167.2	0	0	0	0	0	114.9
562	A	33.9	Very low	38.9	Very low	90 Å²	90	126.9 Å²	126.9	74%	0.744	69%	0.689	S	S	*	*			trans	-133.8	140.9	172.3	0	0	0	0	0	113
563	P	35.6	Very low	37.6	Very low	134 Å²	134	128.6 Å²	128.6	87%	0.87	69%	0.693	S	S	*	*			trans	-86.1	163.6	-174.2	34.1	-35.8	0	0	0	114.9
564	K	39.5	Very low	36.3	Very low	204 Å²	204	132.6 Å²	132.6	89%	0.887	71%	0.712	S	S	*	*			trans	-91.2	139.8	-164.3	-56.4	175.1	-178.2	177.7	0	115.8
565	K	31.8	Very low	35.5	Very low	210 Å²	210	138 Å²	138	91%	0.913	75%	0.745	S	S	*	*			trans	-173.7	143.4	145.1	-95.8	156.5	-176.2	-175.3	0	105.2
566	Q	31	Very low	34.5	Very low	199 Å²	199	140.5 Å²	140.5	93%	0.93	76%	0.757	S	S	*	*			cis	-128.9	-158	22.9	-61.3	177.2	-21.1	0	0	112.8
567	L	33.6	Very low	34.2	Very low	161 Å²	161	135.8 Å²	135.8	84%	0.843	76%	0.76	S	S	*	*			trans	-118.3	123.1	-172.5	166.6	70.7	0	0	0	111.9
568	T	24.3	Very low	33.3	Very low	139 Å²	139	140.6 Å²	140.6	85%	0.853	78%	0.777	S	S	*	*			trans	-159.5	163.8	151.8	8.9	0	0	0	0	111.5
569	Q	31.3	Very low	33.2	Very low	180 Å²	180	142.3 Å²	142.3	84%	0.841	79%	0.794	S	S	*	*			trans	-75.6	164.5	173.5	-64.8	166.6	-30.2	0	0	109.6
570	I	27.3	Very low	33.3	Very low	155 Å²	155	142.9 Å²	142.9	80%	0.795	79%	0.792	S	S	*	*				-165.2	142.9	63.6	-81.4	174	0	0	0	111.2
571	S	27.1	Very low	33.2	Very low	102 Å²	102	143.9 Å²	143.9	71%	0.713	80%	0.798	S	S	*	*			trans	61	141.8	157.2	-146.9	0	0	0	0	122.3
572	S	28.4	Very low	33.9	Very low	99 Å²	99	144 Å²	144	69%	0.692	79%	0.785	S	S	*	*			trans	17.4	150.7	145.3	-55	0	0	0	0	122.4
573	D	28.1	Very low	35.1	Very low	145 Å²	145	147.9 Å²	147.9	78%	0.775	79%	0.785	S	S	*	*			cis	-156.3	160.1	30.3	-142.3	-24.9	0	0	0	116.4
574	N	27.1	Very low	36.7	Very low	128 Å²	128	144.3 Å²	144.3	68%	0.684	76%	0.764	S	S	*	*			trans	60.9	152.4	149	-137.3	-11.2	0	0	0	123.4
575	T	37.3	Very low	38.7	Very low	117 Å²	117	139 Å²	139	72%	0.718	74%	0.739	S	S	*	*			trans	51.8	90.2	163.5	48.7	0	0	0	0	119.5
576	Q	30.5	Very low	41.1	Very low	201 Å²	201	136 Å²	136	94%	0.939	73%	0.725	S	S	*	*			trans	-152.2	149.4	133.1	-118.3	170.1	55.1	0	0	112.9	K578	Q576-K578 PolarHBondContact O-N 2.91Å
577	G	37.2	Very low	43.8	Very low	71 Å²	71	126.7 Å²	126.7	73%	0.732	68%	0.683	S	S	*	*			trans	-70.7	115	-171.9	0	0	0	0	0	112.6	V579	G577-V579 VanDerWaalsContact C-N 3.33Å; G577-V579 PolarHBondContact O-N 3.42Å
578	K	31.3	Very low	46	Very low	186 Å²	186	124.2 Å²	124.2	81%	0.809	68%	0.679	S	S	*	*			trans	-68.4	87.5	175.5	-171.3	171.1	-173	165.9	0	110.9	Q576 L580	Q576-K578 PolarHBondContact O-N 2.91Å; K578-L580 HydrophobicContact CG-CD2 4.41Å; K578-L580 PolarHBondContact O-N 3.31Å
579	V	40.1	Very low	48.6	Very low	135 Å²	135	123.3 Å²	123.3	82%	0.818	67%	0.665	S	S	*	*			trans	-56.8	105.5	167.2	177.8	0	0	0	0	107.7	G577 N581	G577-V579 VanDerWaalsContact C-N 3.33Å; G577-V579 PolarHBondContact O-N 3.42Å; V579-N581 PolarHBondContact O-N 3.12Å
580	L	41.9	Very low	51.1	Low	133 Å²	133	117.2 Å²	117.2	70%	0.696	64%	0.642	S	S	*	*			trans	-69.6	103.3	173.4	-68.1	178.3	0	0	0	107.4	K578 I582	K578-L580 HydrophobicContact CG-CD2 4.41Å; K578-L580 PolarHBondContact O-N 3.31Å; L580-I582 VanDerWaalsContact C-N 3.32Å; L580-I582 WeakPolarHBondContact O-CG1 3.32Å; L580-I582 PolarHBondContact O-N 2.79Å
581	N	41.5	Very low	53.5	Low	142 Å²	142	112.2 Å²	112.2	76%	0.759	63%	0.628	S	S	*	*			trans	-60	97.2	167.4	-174.7	-44.2	0	0	0	108	V579 K583	V579-N581 PolarHBondContact O-N 3.12Å; N581-K583 VanDerWaalsContact C-N 3.27Å; N581-K583 PolarHBondContact O-N 3.07Å
582	I	53.1	Low	56	Low	92 Å²	92	113.4 Å²	113.4	47%	0.472	62%	0.621	S	S	.	*			trans	-71.3	90.6	177.9	-58	-179.8	0	0	0	106.6	L580 S584 R595	L580-I582 VanDerWaalsContact C-N 3.32Å; L580-I582 WeakPolarHBondContact O-CG1 3.32Å; L580-I582 PolarHBondContact O-N 2.79Å; I582-S584 PolarHBondContact O-N 3.06Å; I582-R595 HydrophobicContact CG2-CB 4.27Å; I582-R595 HydrophobicContact CG2-CG 4.36Å
583	K	58.7	Low	58.5	Low	172 Å²	172	111.4 Å²	111.4	75%	0.748	61%	0.606	S	S	*	*			trans	-51.9	98.7	-177.6	-159.6	169.7	-170.9	173.5	0	109.8	N581 Y585	N581-K583 VanDerWaalsContact C-N 3.27Å; N581-K583 PolarHBondContact O-N 3.07Å; K583-Y585 WeakPolarHBondContact O-CE2 3.37Å
584	S	70.6	Confident	61.2	Low	60 Å²	60	106.5 Å²	106.5	42%	0.42	58%	0.578	S	S	.	*			trans	-83.7	130.4	-163.9	57.2	0	0	0	0	111.3	I582 K586	I582-S584 PolarHBondContact O-N 3.06Å; S584-K586 PolarHBondContact O-N 2.94Å
585	Y	80	Confident	63.4	Low	92 Å²	92	104.4 Å²	104.4	36%	0.361	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.3	95.2	-176.5	-64	-85.2	0	0	0	108.6	K583 F594 R597	K583-Y585 WeakPolarHBondContact O-CE2 3.37Å; Y585-F594 WeakPolarHBondContact CB-O 3.46Å; Y585-F594 PolarHBondContact N-O 2.92Å; Y585-F594 PolarHBondContact O-N 3.16Å; Y585-R597 HydrophobicContact CD1-CB 3.83Å; Y585-R597 HydrophobicContact CD1-CG 4.22Å; Y585-R597 HydrophobicContact CD2-CB 4.41Å; Y585-R597 VanDerWaalsContact CD2-N 3.34Å; Y585-R597 HydrophobicContact CE1-CB 3.74Å; Y585-R597 HydrophobicContact CE1-CG 4.26Å; Y585-R597 HydrophobicContact CE2-CB 4.33Å; Y585-R597 HydrophobicContact CG-CB 4.17Å
586	K	82.1	Confident	65.3	Low	146 Å²	146	104.7 Å²	104.7	64%	0.635	55%	0.554	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.8	139.2	178.6	-63.4	-176	-178.9	-177.9	0	111.3	S584 K592 L600	S584-K586 PolarHBondContact O-N 2.94Å; K586-K592 CarbonylContact C-O 3.33Å; K586-K592 WeakPolarHBondContact CA-O 3.49Å; K586-L600 WeakPolarHBondContact O-CD2 3.36Å
587	C	88.3	Confident	67.5	Low	5 Å²	5	103.8 Å²	103.8	3%	0.034	54%	0.542	C	S	.	.			trans	-73.4	129	169.2	176.8	0	0	0	0	110.7	E589 G591 K592 F594 L600 M604 H607	C587-E589 VanDerWaalsContact C-N 3.32Å; C587-E589 PolarHBondContact O-N 3.01Å; C587-E589 PolarHBondContact SG-N 3.33Å; C587-E589 VanDerWaalsContact SG-N 3.41Å; C587-G591 VanDerWaalsContact O-CA 3.24Å; C587-G591 WeakPolarHBondContact O-CA 3.24Å; C587-G591 PolarHBondContact O-N 2.93Å; C587-K592 PolarHBondContact N-O 2.85Å; C587-F594 HydrophobicContact CB-CE2 4.29Å; C587-L600 HydrophobicContact CB-CD1 3.73Å; C587-M604 HydrophobicContact CB-SD 4.34Å; C587-H607 VanDerWaalsContact SG-CD2 3.56Å; C587-H607 PolarHBondContact SG-NE2 2.85Å
588	S	79.9	Confident	69.4	Low	108 Å²	108	104.2 Å²	104.2	76%	0.755	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-30.8	176.8	46.9	0	0	0	0	113.6
589	E	79.3	Confident	71.6	Confident	120 Å²	120	98.5 Å²	98.5	56%	0.561	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-19.4	-172.6	-67.1	-179.1	-101.5	0	0	114.2	C587 M604 H607	C587-E589 VanDerWaalsContact C-N 3.32Å; C587-E589 PolarHBondContact O-N 3.01Å; C587-E589 PolarHBondContact SG-N 3.33Å; C587-E589 VanDerWaalsContact SG-N 3.41Å; E589-M604 HydrophobicContact CG-CE 4.2Å; E589-M604 WeakPolarHBondContact OE1-CE 3.34Å; E589-H607 HydrophobicContact CB-CB 4.47Å; E589-H607 VanDerWaalsContact CD-CB 3.48Å; E589-H607 VanDerWaalsContact OE1-CB 3.22Å; E589-H607 WeakPolarHBondContact OE1-CB 3.46Å; E589-H607 IonicContact OE1-CG 2.73Å; E589-H607 WeakPolarHBondContact OE2-CB 3.39Å; E589-H607 IonicContact OE2-CG 3.76Å
590	C	82.6	Confident	73.6	Confident	53 Å²	53	93.3 Å²	93.3	36%	0.358	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.7	17.6	177.4	79.2	0	0	0	0	115.3	K592 H603 H607	C590-K592 PolarHBondContact O-N 2.87Å; C590-H603 PolarHBondContact SG-NE2 3.12Å; C590-H607 PolarHBondContact SG-NE2 3.19Å; C590-H607 VanDerWaalsContact SG-NE2 3.43Å
591	G	78.5	Confident	75.3	Confident	50 Å²	50	91.9 Å²	91.9	52%	0.515	47%	0.471	S	S	.	.			trans	69.5	-17.3	173.1	0	0	0	0	0	117.3	C587 S593	C587-G591 VanDerWaalsContact O-CA 3.24Å; C587-G591 WeakPolarHBondContact O-CA 3.24Å; C587-G591 PolarHBondContact O-N 2.93Å; G591-S593 PolarHBondContact O-N 3.43Å
592	K	80	Confident	77	Confident	127 Å²	127	89.1 Å²	89.1	55%	0.552	46%	0.456	S	S	*	.			trans	-56.7	127.3	-173.5	-69.4	178.5	-173.5	177.7	0	112.2	K586 C587 C590 F594	K586-K592 CarbonylContact C-O 3.33Å; K586-K592 WeakPolarHBondContact CA-O 3.49Å; C587-K592 PolarHBondContact N-O 2.85Å; C590-K592 PolarHBondContact O-N 2.87Å; K592-F594 HydrophobicContact CB-CE2 3.83Å; K592-F594 HydrophobicContact CB-CZ 3.92Å; K592-F594 WeakPolarHBondContact O-CD2 3.48Å; K592-F594 VanDerWaalsContact O-CE2 3.3Å; K592-F594 WeakPolarHBondContact O-CE2 3.21Å
593	S	81.4	Confident	78.3	Confident	56 Å²	56	85.8 Å²	85.8	39%	0.392	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	139.6	177.2	38.4	0	0	0	0	111.8	G591	G591-S593 PolarHBondContact O-N 3.43Å
594	F	84.4	Confident	79.2	Confident	43 Å²	43	79.9 Å²	79.9	19%	0.189	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	139.1	174.6	-59.6	-82.7	0	0	0	110.6	Y585 C587 K592 H596 V599 L600 H603	Y585-F594 WeakPolarHBondContact CB-O 3.46Å; Y585-F594 PolarHBondContact N-O 2.92Å; Y585-F594 PolarHBondContact O-N 3.16Å; C587-F594 HydrophobicContact CB-CE2 4.29Å; K592-F594 HydrophobicContact CB-CE2 3.83Å; K592-F594 HydrophobicContact CB-CZ 3.92Å; K592-F594 WeakPolarHBondContact O-CD2 3.48Å; K592-F594 VanDerWaalsContact O-CE2 3.3Å; K592-F594 WeakPolarHBondContact O-CE2 3.21Å; F594-H596 PolarHBondContact O-N 2.83Å; F594-V599 HydrophobicContact CB-CB 4.42Å; F594-V599 HydrophobicContact CB-CG1 4.45Å; F594-V599 HydrophobicContact CD1-CB 4.46Å; F594-V599 HydrophobicContact CD1-CG1 3.64Å; F594-V599 HydrophobicContact CE1-CG1 4.29Å; F594-V599 HydrophobicContact CG-CG1 4.29Å; F594-L600 HydrophobicContact CB-CB 4.29Å; F594-L600 HydrophobicContact CD2-CB 3.98Å; F594-L600 HydrophobicContact CD2-CD1 3.86Å; F594-L600 HydrophobicContact CE2-CD1 4.08Å; F594-L600 HydrophobicContact CG-CB 4.39Å; F594-H603 HydrophobicContact CE1-CB 4.3Å; F594-H603 HydrophobicContact CE2-CB 3.99Å; F594-H603 AromaticContact CE2-CD2 3.35Å; F594-H603 WeakPolarHBondContact CE2-CD2 3.4Å; F594-H603 AromaticContact CE2-CG 3.62Å; F594-H603 AromaticContact CE2-NE2 3.93Å; F594-H603 HydrophobicContact CZ-CB 3.75Å; F594-H603 AromaticContact CZ-CD2 3.53Å; F594-H603 AromaticContact CZ-CG 3.34Å; F594-H603 AromaticContact CZ-ND1 3.67Å; F594-H603 AromaticContact CZ-NE2 3.92Å
595	R	72.5	Confident	79.5	Confident	84 Å²	84	81.4 Å²	81.4	32%	0.317	41%	0.411	S	S	.	.	S	Bend	trans	-70.3	-12.7	-179.8	-61.8	-170.4	-173	-147.2	0.3	113.4	E503 D504 I582	E503-R595 IonicContact OE2-CZ 3.33Å; E503-R595 IonicContact OE2-NH1 3.99Å; E503-R595 PolarHBondContact OE2-NH1 3.12Å; E503-R595 IonicContact OE2-NH2 3.56Å; E503-R595 PolarHBondContact OE2-NH2 3.41Å; D504-R595 IonicContact OD1-NH2 3.64Å; I582-R595 HydrophobicContact CG2-CB 4.27Å; I582-R595 HydrophobicContact CG2-CG 4.36Å
596	H	78.2	Confident	79.4	Confident	122 Å²	122	81.9 Å²	81.9	57%	0.565	42%	0.419	S	S	*	.	S	Bend	trans	-138.9	138.4	179.2	-60.4	-39.4	0	0	0	113.1	F594 S598 V599 L600	F594-H596 PolarHBondContact O-N 2.83Å; H596-S598 VanDerWaalsContact C-N 3.28Å; H596-S598 PolarHBondContact O-N 3.18Å; H596-V599 HydrophobicContact CB-CG2 4.16Å; H596-V599 PolarHBondContact O-N 3.46Å; H596-L600 PolarHBondContact O-N 3.07Å; H596-L600 VanDerWaalsContact O-N 3.15Å
597	R	76.3	Confident	79.1	Confident	182 Å²	182	77.4 Å²	77.4	69%	0.687	40%	0.4	S	S	*	.	H	α-helix	trans	-56.4	-37.5	177.3	-173.4	177.4	172.6	115.3	-0.9	113.1	Y585 V599 L600 E601	Y585-R597 HydrophobicContact CD1-CB 3.83Å; Y585-R597 HydrophobicContact CD1-CG 4.22Å; Y585-R597 HydrophobicContact CD2-CB 4.41Å; Y585-R597 VanDerWaalsContact CD2-N 3.34Å; Y585-R597 HydrophobicContact CE1-CB 3.74Å; Y585-R597 HydrophobicContact CE1-CG 4.26Å; Y585-R597 HydrophobicContact CE2-CB 4.33Å; Y585-R597 HydrophobicContact CG-CB 4.17Å; R597-V599 VanDerWaalsContact C-N 3.31Å; R597-V599 PolarHBondContact O-N 3.38Å; R597-L600 PolarHBondContact O-N 3.08Å; R597-E601 WeakPolarHBondContact O-CB 3.24Å; R597-E601 PolarHBondContact O-N 3.12Å
598	S	76.4	Confident	78.2	Confident	80 Å²	80	80 Å²	80	56%	0.559	42%	0.418	S	S	*	.	H	α-helix	trans	-65.2	-31.3	177.5	50.3	0	0	0	0	113.4	H596 L602	H596-S598 VanDerWaalsContact C-N 3.28Å; H596-S598 PolarHBondContact O-N 3.18Å; S598-L602 WeakPolarHBondContact O-CB 3.47Å; S598-L602 PolarHBondContact O-N 3.27Å
599	V	78.8	Confident	77.7	Confident	66 Å²	66	83.9 Å²	83.9	40%	0.4	42%	0.421	S	S	.	.	H	α-helix	trans	-77.6	-38.3	175.5	-177.3	0	0	0	0	110.4	F594 H596 R597 L602 H603	F594-V599 HydrophobicContact CB-CB 4.42Å; F594-V599 HydrophobicContact CB-CG1 4.45Å; F594-V599 HydrophobicContact CD1-CB 4.46Å; F594-V599 HydrophobicContact CD1-CG1 3.64Å; F594-V599 HydrophobicContact CE1-CG1 4.29Å; F594-V599 HydrophobicContact CG-CG1 4.29Å; H596-V599 HydrophobicContact CB-CG2 4.16Å; H596-V599 PolarHBondContact O-N 3.46Å; R597-V599 VanDerWaalsContact C-N 3.31Å; R597-V599 PolarHBondContact O-N 3.38Å; V599-L602 PolarHBondContact O-N 2.79Å; V599-H603 WeakPolarHBondContact O-CB 3.42Å; V599-H603 PolarHBondContact O-N 3.36Å
600	L	81.1	Confident	77.4	Confident	27 Å²	27	83.3 Å²	83.3	14%	0.141	42%	0.422	C	S	.	.	H	α-helix	trans	-59.3	-48	168.9	171.5	60.7	0	0	0	111	K586 C587 F594 H596 R597 L602 H603 M604	K586-L600 WeakPolarHBondContact O-CD2 3.36Å; C587-L600 HydrophobicContact CB-CD1 3.73Å; F594-L600 HydrophobicContact CB-CB 4.29Å; F594-L600 HydrophobicContact CD2-CB 3.98Å; F594-L600 HydrophobicContact CD2-CD1 3.86Å; F594-L600 HydrophobicContact CE2-CD1 4.08Å; F594-L600 HydrophobicContact CG-CB 4.39Å; H596-L600 PolarHBondContact O-N 3.07Å; H596-L600 VanDerWaalsContact O-N 3.15Å; R597-L600 PolarHBondContact O-N 3.08Å; L600-L602 VanDerWaalsContact C-N 3.33Å; L600-L602 PolarHBondContact O-N 3.02Å; L600-H603 CarbonylContact O-C 3.31Å; L600-H603 WeakPolarHBondContact O-CA 3.47Å; L600-H603 WeakPolarHBondContact O-CB 3.45Å; L600-H603 PolarHBondContact O-N 3.28Å; L600-M604 HydrophobicContact CD1-CG 4.11Å; L600-M604 HydrophobicContact CD1-SD 3.76Å; L600-M604 HydrophobicContact CG-CG 4.35Å; L600-M604 WeakPolarHBondContact O-CG 3.27Å; L600-M604 PolarHBondContact O-N 3.37Å
601	E	77.2	Confident	77.2	Confident	102 Å²	102	85.9 Å²	85.9	48%	0.477	43%	0.427	S	S	.	.	H	α-helix	trans	-61.4	-40.6	180	-166.6	-151.2	117.6	0	0	112	R597 H603 M604 R605	R597-E601 WeakPolarHBondContact O-CB 3.24Å; R597-E601 PolarHBondContact O-N 3.12Å; E601-H603 VanDerWaalsContact C-N 3.29Å; E601-H603 PolarHBondContact O-N 3.13Å; E601-M604 PolarHBondContact O-N 2.82Å; E601-R605 IonicContact OE1-CZ 3.47Å; E601-R605 IonicContact OE1-NE 3.68Å; E601-R605 IonicContact OE1-NH2 3.24Å; E601-R605 PolarHBondContact OE1-NH2 2.87Å
602	L	78.9	Confident	77.2	Confident	85 Å²	85	87.1 Å²	87.1	45%	0.445	43%	0.426	S	S	.	.	H	α-helix	trans	-60.9	-39.2	171.7	-162.5	81.2	0	0	0	111.6	S598 V599 L600 R605 F624	S598-L602 WeakPolarHBondContact O-CB 3.47Å; S598-L602 PolarHBondContact O-N 3.27Å; V599-L602 PolarHBondContact O-N 2.79Å; L600-L602 VanDerWaalsContact C-N 3.33Å; L600-L602 PolarHBondContact O-N 3.02Å; L602-R605 PolarHBondContact O-N 2.79Å; L602-F624 HydrophobicContact CD1-CD1 3.99Å; L602-F624 HydrophobicContact CD1-CE1 3.38Å; L602-F624 HydrophobicContact CD1-CZ 4.1Å; L602-F624 HydrophobicContact CG-CE1 3.76Å; L602-F624 HydrophobicContact CG-CZ 3.95Å
603	H	79.9	Confident	77.3	Confident	22 Å²	22	85 Å²	85	10%	0.102	42%	0.416	C	S	.	.	H	α-helix	trans	-70.8	-35.4	177.5	172.3	73.2	0	0	0	113.3	C590 F594 V599 L600 E601 R605 I606 H607	C590-H603 PolarHBondContact SG-NE2 3.12Å; F594-H603 HydrophobicContact CE1-CB 4.3Å; F594-H603 HydrophobicContact CE2-CB 3.99Å; F594-H603 AromaticContact CE2-CD2 3.35Å; F594-H603 WeakPolarHBondContact CE2-CD2 3.4Å; F594-H603 AromaticContact CE2-CG 3.62Å; F594-H603 AromaticContact CE2-NE2 3.93Å; F594-H603 HydrophobicContact CZ-CB 3.75Å; F594-H603 AromaticContact CZ-CD2 3.53Å; F594-H603 AromaticContact CZ-CG 3.34Å; F594-H603 AromaticContact CZ-ND1 3.67Å; F594-H603 AromaticContact CZ-NE2 3.92Å; V599-H603 WeakPolarHBondContact O-CB 3.42Å; V599-H603 PolarHBondContact O-N 3.36Å; L600-H603 CarbonylContact O-C 3.31Å; L600-H603 WeakPolarHBondContact O-CA 3.47Å; L600-H603 WeakPolarHBondContact O-CB 3.45Å; L600-H603 PolarHBondContact O-N 3.28Å; E601-H603 VanDerWaalsContact C-N 3.29Å; E601-H603 PolarHBondContact O-N 3.13Å; H603-R605 PolarHBondContact O-N 3.01Å; H603-R605 VanDerWaalsContact O-N 3.15Å; H603-I606 VanDerWaalsContact O-CB 3.24Å; H603-I606 WeakPolarHBondContact O-CB 3.47Å; H603-I606 WeakPolarHBondContact O-CG1 3.45Å; H603-I606 PolarHBondContact O-N 3.31Å; H603-H607 AromaticContact CD2-NE2 3.91Å; H603-H607 AromaticContact CE1-NE2 3.65Å; H603-H607 AromaticContact NE2-CD2 3.88Å; H603-H607 AromaticContact NE2-NE2 3.12Å; H603-H607 PolarHBondContact NE2-NE2 3.06Å; H603-H607 VanDerWaalsContact NE2-NE2 3.12Å
604	M	76.8	Confident	77.5	Confident	48 Å²	48	88.7 Å²	88.7	24%	0.236	43%	0.426	C	S	.	.	H	α-helix	trans	-60.2	-25.1	174.7	-64.2	-48.9	-64.4	0	0	112.5	C587 E589 L600 E601 I606 H607 S608	C587-M604 HydrophobicContact CB-SD 4.34Å; E589-M604 HydrophobicContact CG-CE 4.2Å; E589-M604 WeakPolarHBondContact OE1-CE 3.34Å; L600-M604 HydrophobicContact CD1-CG 4.11Å; L600-M604 HydrophobicContact CD1-SD 3.76Å; L600-M604 HydrophobicContact CG-CG 4.35Å; L600-M604 WeakPolarHBondContact O-CG 3.27Å; L600-M604 PolarHBondContact O-N 3.37Å; E601-M604 PolarHBondContact O-N 2.82Å; M604-I606 PolarHBondContact O-N 3.28Å; M604-H607 PolarHBondContact O-N 3.35Å; M604-S608 PolarHBondContact O-N 3.24Å
605	R	77.8	Confident	77.8	Confident	92 Å²	92	86.8 Å²	86.8	35%	0.347	42%	0.418	S	S	.	.	H	α-helix	trans	-72.8	-5.4	172.8	-51.4	-178.4	-158.5	-176.5	1.9	113.5	E601 L602 H603 R623 F624	E601-R605 IonicContact OE1-CZ 3.47Å; E601-R605 IonicContact OE1-NE 3.68Å; E601-R605 IonicContact OE1-NH2 3.24Å; E601-R605 PolarHBondContact OE1-NH2 2.87Å; L602-R605 PolarHBondContact O-N 2.79Å; H603-R605 PolarHBondContact O-N 3.01Å; H603-R605 VanDerWaalsContact O-N 3.15Å; R605-R623 WeakPolarHBondContact O-CD 3.23Å; R605-R623 WeakPolarHBondContact O-CG 3.31Å; R605-R623 PolarHBondContact O-NH1 2.58Å; R605-F624 HydrophobicContact CB-CE1 4.36Å; R605-F624 HydrophobicContact CB-CZ 4.33Å
606	I	76.7	Confident	78.3	Confident	102 Å²	102	92.9 Å²	92.9	52%	0.523	45%	0.447	S	S	.	.	H	α-helix	trans	-78.3	-44.7	167.6	-56.8	-178.9	0	0	0	109.2	H603 M604 R623	H603-I606 VanDerWaalsContact O-CB 3.24Å; H603-I606 WeakPolarHBondContact O-CB 3.47Å; H603-I606 WeakPolarHBondContact O-CG1 3.45Å; H603-I606 PolarHBondContact O-N 3.31Å; M604-I606 PolarHBondContact O-N 3.28Å; I606-R623 PolarHBondContact O-NH1 3.1Å
607	H	75.9	Confident	78.5	Confident	52 Å²	52	91.5 Å²	91.5	24%	0.241	45%	0.447	C	S	.	.	H	α-helix	trans	-72.5	-50.7	-179.4	-60.4	-56.2	0	0	0	113	C587 E589 C590 H603 M604 K609	C587-H607 VanDerWaalsContact SG-CD2 3.56Å; C587-H607 PolarHBondContact SG-NE2 2.85Å; E589-H607 HydrophobicContact CB-CB 4.47Å; E589-H607 VanDerWaalsContact CD-CB 3.48Å; E589-H607 VanDerWaalsContact OE1-CB 3.22Å; E589-H607 WeakPolarHBondContact OE1-CB 3.46Å; E589-H607 IonicContact OE1-CG 2.73Å; E589-H607 WeakPolarHBondContact OE2-CB 3.39Å; E589-H607 IonicContact OE2-CG 3.76Å; C590-H607 PolarHBondContact SG-NE2 3.19Å; C590-H607 VanDerWaalsContact SG-NE2 3.43Å; H603-H607 AromaticContact CD2-NE2 3.91Å; H603-H607 AromaticContact CE1-NE2 3.65Å; H603-H607 AromaticContact NE2-CD2 3.88Å; H603-H607 AromaticContact NE2-NE2 3.12Å; H603-H607 PolarHBondContact NE2-NE2 3.06Å; H603-H607 VanDerWaalsContact NE2-NE2 3.12Å; M604-H607 PolarHBondContact O-N 3.35Å; H607-K609 PolarHBondContact O-N 2.89Å
608	S	69.7	Low	79	Confident	60 Å²	60	85.2 Å²	85.2	42%	0.42	43%	0.43	S	S	.	.	S	Bend	trans	-53.3	127.7	175.3	176.1	0	0	0	0	110.5	M604 D610 R623	M604-S608 PolarHBondContact O-N 3.24Å; S608-D610 PolarHBondContact O-N 2.86Å; S608-D610 PolarHBondContact OG-N 2.87Å; S608-R623 PolarHBondContact O-NE 3.34Å; S608-R623 PolarHBondContact O-NH1 3Å; S608-R623 PolarHBondContact O-NH2 3.4Å
609	K	69.1	Low	79.3	Confident	189 Å²	189	84 Å²	84	82%	0.822	43%	0.431	S	S	*	.			trans	-67.1	-23.3	-178.5	-73.6	179.8	-179.4	172.5	0	112.5	H607 R623	H607-K609 PolarHBondContact O-N 2.89Å; K609-R623 VanDerWaalsContact C-NH2 3.27Å; K609-R623 PolarHBondContact O-NH2 3.43Å
610	D	72.8	Confident	79.6	Confident	108 Å²	108	87.2 Å²	87.2	58%	0.578	44%	0.439	S	S	*	.			trans	-58.3	135.3	-174.4	-175.3	16.3	0	0	0	113.6	S608 R623	S608-D610 PolarHBondContact O-N 2.86Å; S608-D610 PolarHBondContact OG-N 2.87Å; D610-R623 WeakPolarHBondContact O-CD 3.34Å; D610-R623 PolarHBondContact O-NE 2.83Å
611	K	79.6	Confident	79.7	Confident	106 Å²	106	86.8 Å²	86.8	46%	0.461	44%	0.442	S	S	.	.			trans	-129	72.6	-173.5	-77.2	170.8	168.4	-177.5	0	110.1	Y613 G621 F622	K611-Y613 VanDerWaalsContact C-N 3.26Å; K611-Y613 PolarHBondContact O-N 3.01Å; K611-Y613 VanDerWaalsContact O-N 3.17Å; K611-G621 WeakPolarHBondContact CD-O 3.35Å; K611-F622 CarbonylContact C-O 3.55Å
612	P	78.3	Confident	80	Confident	77 Å²	77	84.1 Å²	84.1	50%	0.5	43%	0.429	S	S	.	.			trans	-65.8	-22	-168.8	23.8	-34.6	0	0	0	114.6	Q614	P612-Q614 PolarHBondContact O-N 3.21Å
613	Y	81.7	Confident	80.1	Confident	83 Å²	83	82.5 Å²	82.5	33%	0.325	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	83.6	-177.4	-56.2	-71.8	0	0	0	111.3	K611 F622 R623 F624 S625	K611-Y613 VanDerWaalsContact C-N 3.26Å; K611-Y613 PolarHBondContact O-N 3.01Å; K611-Y613 VanDerWaalsContact O-N 3.17Å; Y613-F622 PolarHBondContact N-O 2.82Å; Y613-F622 VanDerWaalsContact N-O 3.17Å; Y613-F622 PolarHBondContact O-N 3.43Å; Y613-R623 WeakPolarHBondContact CE2-O 3.49Å; Y613-F624 VanDerWaalsContact CD2-C 3.42Å; Y613-S625 VanDerWaalsContact CD2-N 3.34Å
614	Q	85.5	Confident	80.1	Confident	133 Å²	133	83.2 Å²	83.2	62%	0.621	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	139.2	179.9	-59.6	-173.7	16.8	0	0	113.3	P612 K616	P612-Q614 PolarHBondContact O-N 3.21Å; Q614-K616 PolarHBondContact O-N 3.38Å
615	C	90	Very high	80.3	Confident	2 Å²	2	84 Å²	84	1%	0.014	43%	0.43	C	S	.	.			trans	-79.9	111.6	173.5	-175.4	0	0	0	0	111.4	V617 C618 G619 K620 F622 L628 H631	C615-V617 PolarHBondContact O-N 2.97Å; C615-C618 PolarHBondContact O-N 3.28Å; C615-G619 WeakPolarHBondContact O-CA 3.48Å; C615-G619 PolarHBondContact O-N 3.39Å; C615-K620 WeakPolarHBondContact CB-O 3.41Å; C615-K620 PolarHBondContact N-O 2.78Å; C615-F622 HydrophobicContact CB-CE2 4.28Å; C615-L628 HydrophobicContact CB-CD1 3.68Å; C615-H631 VanDerWaalsContact SG-CD2 3.53Å; C615-H631 PolarHBondContact SG-NE2 3.03Å
616	K	83.3	Confident	80.4	Confident	213 Å²	213	82.9 Å²	82.9	93%	0.926	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-17.3	176.8	-64.3	-169.2	176.7	-170.9	0	114.6	Q614	Q614-K616 PolarHBondContact O-N 3.38Å
617	V	83.6	Confident	80.6	Confident	92 Å²	92	84 Å²	84	56%	0.558	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-20.2	-176.2	-164.8	0	0	0	0	113.2	C615 L632 H635	C615-V617 PolarHBondContact O-N 2.97Å; V617-L632 HydrophobicContact CG2-CD2 4.27Å; V617-H635 HydrophobicContact CB-CB 4.32Å; V617-H635 HydrophobicContact CG1-CB 4.14Å; V617-H635 VanDerWaalsContact CG1-ND1 3.33Å; V617-H635 WeakPolarHBondContact CG1-ND1 3.45Å; V617-H635 HydrophobicContact CG2-CB 4.35Å
618	C	85.9	Confident	81	Confident	51 Å²	51	82.8 Å²	82.8	35%	0.345	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.3	13.6	179.5	71.3	0	0	0	0	115.8	C615 K620 H631 H635	C615-C618 PolarHBondContact O-N 3.28Å; C618-K620 PolarHBondContact O-N 2.89Å; C618-K620 VanDerWaalsContact SG-CG 3.6Å; C618-H631 PolarHBondContact SG-NE2 3.17Å; C618-H635 PolarHBondContact SG-NE2 2.99Å
619	G	82.9	Confident	81.6	Confident	55 Å²	55	86.5 Å²	86.5	57%	0.567	44%	0.44	S	S	*	.			trans	68.7	-7.5	179.3	0	0	0	0	0	115.8	C615 G621	C615-G619 WeakPolarHBondContact O-CA 3.48Å; C615-G619 PolarHBondContact O-N 3.39Å; G619-G621 PolarHBondContact O-N 2.88Å
620	K	84.8	Confident	82.2	Confident	132 Å²	132	81.5 Å²	81.5	57%	0.574	42%	0.42	S	S	*	.			trans	-65.6	118.4	-175	-69.5	-179.2	-176.6	-179.8	0	111.4	C615 C618 F622	C615-K620 WeakPolarHBondContact CB-O 3.41Å; C615-K620 PolarHBondContact N-O 2.78Å; C618-K620 PolarHBondContact O-N 2.89Å; C618-K620 VanDerWaalsContact SG-CG 3.6Å; K620-F622 HydrophobicContact CB-CE2 3.84Å; K620-F622 HydrophobicContact CB-CZ 4.15Å; K620-F622 VanDerWaalsContact O-CD2 3.23Å; K620-F622 WeakPolarHBondContact O-CD2 3.2Å; K620-F622 WeakPolarHBondContact O-CE2 3.4Å
621	G	84.3	Confident	82.7	Confident	19 Å²	19	77.3 Å²	77.3	20%	0.196	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	134.3	175.9	0	0	0	0	0	113.6	K611 G619	K611-G621 WeakPolarHBondContact CD-O 3.35Å; G619-G621 PolarHBondContact O-N 2.88Å
622	F	83.6	Confident	82.9	Confident	46 Å²	46	75.2 Å²	75.2	20%	0.202	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	154.3	178.2	-62.1	-91.9	0	0	0	111.3	K611 Y613 C615 K620 L628 H631	K611-F622 CarbonylContact C-O 3.55Å; Y613-F622 PolarHBondContact N-O 2.82Å; Y613-F622 VanDerWaalsContact N-O 3.17Å; Y613-F622 PolarHBondContact O-N 3.43Å; C615-F622 HydrophobicContact CB-CE2 4.28Å; K620-F622 HydrophobicContact CB-CE2 3.84Å; K620-F622 HydrophobicContact CB-CZ 4.15Å; K620-F622 VanDerWaalsContact O-CD2 3.23Å; K620-F622 WeakPolarHBondContact O-CD2 3.2Å; K620-F622 WeakPolarHBondContact O-CE2 3.4Å; F622-L628 HydrophobicContact CB-CB 4.35Å; F622-L628 HydrophobicContact CD2-CB 4.18Å; F622-L628 HydrophobicContact CD2-CD1 4.07Å; F622-L628 HydrophobicContact CE2-CD1 4.35Å; F622-L628 HydrophobicContact CG-CB 4.41Å; F622-H631 HydrophobicContact CE1-CB 4.05Å; F622-H631 HydrophobicContact CE2-CB 4.03Å; F622-H631 AromaticContact CE2-CD2 3.23Å; F622-H631 WeakPolarHBondContact CE2-CD2 3.29Å; F622-H631 AromaticContact CE2-CG 3.68Å; F622-H631 AromaticContact CE2-NE2 3.87Å; F622-H631 HydrophobicContact CZ-CB 3.58Å; F622-H631 AromaticContact CZ-CD2 3.37Å; F622-H631 WeakPolarHBondContact CZ-CD2 3.18Å; F622-H631 AromaticContact CZ-CG 3.32Å; F622-H631 AromaticContact CZ-ND1 3.89Å; F622-H631 AromaticContact CZ-NE2 3.95Å
623	R	80.1	Confident	83.1	Confident	51 Å²	51	73.4 Å²	73.4	19%	0.192	38%	0.376	C	S	.	.	S	Bend	trans	-82.3	-20.2	178.9	-63.3	-63.8	170.5	63.3	1.1	114.4	R605 I606 S608 K609 D610 Y613	R605-R623 WeakPolarHBondContact O-CD 3.23Å; R605-R623 WeakPolarHBondContact O-CG 3.31Å; R605-R623 PolarHBondContact O-NH1 2.58Å; I606-R623 PolarHBondContact O-NH1 3.1Å; S608-R623 PolarHBondContact O-NE 3.34Å; S608-R623 PolarHBondContact O-NH1 3Å; S608-R623 PolarHBondContact O-NH2 3.4Å; K609-R623 VanDerWaalsContact C-NH2 3.27Å; K609-R623 PolarHBondContact O-NH2 3.43Å; D610-R623 WeakPolarHBondContact O-CD 3.34Å; D610-R623 PolarHBondContact O-NE 2.83Å; Y613-R623 WeakPolarHBondContact CE2-O 3.49Å
624	F	80.4	Confident	83.1	Confident	36 Å²	36	75.5 Å²	75.5	16%	0.158	39%	0.392	C	S	.	.	S	Bend	trans	-137.1	139.4	-178.5	-52.1	-68.8	0	0	0	110.4	L602 R605 Y613 S626 Y627 L628	L602-F624 HydrophobicContact CD1-CD1 3.99Å; L602-F624 HydrophobicContact CD1-CE1 3.38Å; L602-F624 HydrophobicContact CD1-CZ 4.1Å; L602-F624 HydrophobicContact CG-CE1 3.76Å; L602-F624 HydrophobicContact CG-CZ 3.95Å; R605-F624 HydrophobicContact CB-CE1 4.36Å; R605-F624 HydrophobicContact CB-CZ 4.33Å; Y613-F624 VanDerWaalsContact CD2-C 3.42Å; F624-S626 PolarHBondContact O-N 2.86Å; F624-Y627 HydrophobicContact CB-CD2 4.28Å; F624-Y627 AromaticContact CD2-CD2 3.73Å; F624-Y627 HydrophobicContact CD2-CD2 3.73Å; F624-Y627 AromaticContact CD2-CE2 3.62Å; F624-Y627 HydrophobicContact CD2-CE2 3.62Å; F624-Y627 HydrophobicContact CE2-CE2 4.25Å; F624-Y627 PolarHBondContact O-N 3.23Å; F624-Y627 VanDerWaalsContact O-N 3.08Å; F624-L628 PolarHBondContact O-N 3.12Å
625	S	79.8	Confident	82.8	Confident	66 Å²	66	72.8 Å²	72.8	46%	0.462	38%	0.379	S	S	.	.	H	α-helix	trans	-59.6	-31.9	178.1	51.6	0	0	0	0	112.7	Y613 Y627 L628 Q629	Y613-S625 VanDerWaalsContact CD2-N 3.34Å; S625-Y627 PolarHBondContact O-N 3.13Å; S625-L628 PolarHBondContact O-N 3.48Å; S625-Q629 WeakPolarHBondContact O-CB 3.41Å; S625-Q629 PolarHBondContact O-N 2.76Å
626	S	80.1	Confident	82.2	Confident	67 Å²	67	76.6 Å²	76.6	47%	0.469	40%	0.402	S	S	.	.	H	α-helix	trans	-59.5	-42.4	173.1	51.4	0	0	0	0	112.7	F624 Q629 Q630	F624-S626 PolarHBondContact O-N 2.86Å; S626-Q629 PolarHBondContact O-N 3.48Å; S626-Q630 VanDerWaalsContact O-CB 3.3Å; S626-Q630 WeakPolarHBondContact O-CB 3.45Å; S626-Q630 PolarHBondContact O-N 3.33Å
627	Y	81.7	Confident	81.9	Confident	126 Å²	126	68.9 Å²	68.9	49%	0.494	38%	0.383	S	S	.	.	H	α-helix	trans	-73.8	-33.3	176.2	-65.5	-28.8	0	0	0	112.5	F624 S625 Q630 H631	F624-Y627 HydrophobicContact CB-CD2 4.28Å; F624-Y627 AromaticContact CD2-CD2 3.73Å; F624-Y627 HydrophobicContact CD2-CD2 3.73Å; F624-Y627 AromaticContact CD2-CE2 3.62Å; F624-Y627 HydrophobicContact CD2-CE2 3.62Å; F624-Y627 HydrophobicContact CE2-CE2 4.25Å; F624-Y627 PolarHBondContact O-N 3.23Å; F624-Y627 VanDerWaalsContact O-N 3.08Å; S625-Y627 PolarHBondContact O-N 3.13Å; Y627-Q630 PolarHBondContact O-N 2.83Å; Y627-H631 VanDerWaalsContact O-CB 3.24Å; Y627-H631 WeakPolarHBondContact O-CB 3.4Å; Y627-H631 PolarHBondContact O-N 3.4Å
628	L	84.9	Confident	81.5	Confident	27 Å²	27	72.1 Å²	72.1	14%	0.141	39%	0.389	C	S	.	.	H	α-helix	trans	-61.7	-47.1	169.3	172	59.2	0	0	0	110.9	C615 F622 F624 S625 Q630 H631 L632	C615-L628 HydrophobicContact CB-CD1 3.68Å; F622-L628 HydrophobicContact CB-CB 4.35Å; F622-L628 HydrophobicContact CD2-CB 4.18Å; F622-L628 HydrophobicContact CD2-CD1 4.07Å; F622-L628 HydrophobicContact CE2-CD1 4.35Å; F622-L628 HydrophobicContact CG-CB 4.41Å; F624-L628 PolarHBondContact O-N 3.12Å; S625-L628 PolarHBondContact O-N 3.48Å; L628-Q630 VanDerWaalsContact C-N 3.34Å; L628-Q630 PolarHBondContact O-N 2.91Å; L628-H631 CarbonylContact O-C 3.48Å; L628-H631 PolarHBondContact O-N 3.49Å; L628-H631 VanDerWaalsContact O-N 3.13Å; L628-L632 HydrophobicContact CD1-CD1 4.18Å; L628-L632 HydrophobicContact CD1-CG 4.07Å; L628-L632 HydrophobicContact CG-CD1 4.12Å; L628-L632 HydrophobicContact CG-CG 4.47Å; L628-L632 WeakPolarHBondContact O-CG 3.15Å; L628-L632 PolarHBondContact O-N 2.88Å
629	Q	80.8	Confident	81.3	Confident	137 Å²	137	75 Å²	75	64%	0.64	40%	0.396	S	S	*	.	H	α-helix	trans	-62.6	-40.5	176.6	-171.1	178.6	4.7	0	0	111.8	S625 S626 H631 L632	S625-Q629 WeakPolarHBondContact O-CB 3.41Å; S625-Q629 PolarHBondContact O-N 2.76Å; S626-Q629 PolarHBondContact O-N 3.48Å; Q629-H631 VanDerWaalsContact C-N 3.27Å; Q629-H631 PolarHBondContact O-N 3.39Å; Q629-L632 PolarHBondContact O-N 3.1Å
630	Q	82.2	Confident	81	Confident	85 Å²	85	76.5 Å²	76.5	40%	0.397	40%	0.396	S	S	.	.	H	α-helix	trans	-60	-37.7	173.4	-164.4	-177.5	2.4	0	0	112	S626 Y627 L628 F652	S626-Q630 VanDerWaalsContact O-CB 3.3Å; S626-Q630 WeakPolarHBondContact O-CB 3.45Å; S626-Q630 PolarHBondContact O-N 3.33Å; Y627-Q630 PolarHBondContact O-N 2.83Å; L628-Q630 VanDerWaalsContact C-N 3.34Å; L628-Q630 PolarHBondContact O-N 2.91Å; Q630-F652 HydrophobicContact CB-CE1 4.32Å; Q630-F652 HydrophobicContact CB-CZ 4.46Å; Q630-F652 HydrophobicContact CG-CD1 4.14Å; Q630-F652 HydrophobicContact CG-CE1 3.33Å; Q630-F652 HydrophobicContact CG-CE2 4.02Å; Q630-F652 HydrophobicContact CG-CZ 3.25Å
631	H	84.4	Confident	80.9	Confident	20 Å²	20	74.6 Å²	74.6	9%	0.093	39%	0.386	C	S	.	.	H	α-helix	trans	-77.9	-33.9	178.9	167	63.3	0	0	0	113.4	C615 C618 F622 Y627 L628 Q629 I633 I634 H635	C615-H631 VanDerWaalsContact SG-CD2 3.53Å; C615-H631 PolarHBondContact SG-NE2 3.03Å; C618-H631 PolarHBondContact SG-NE2 3.17Å; F622-H631 HydrophobicContact CE1-CB 4.05Å; F622-H631 HydrophobicContact CE2-CB 4.03Å; F622-H631 AromaticContact CE2-CD2 3.23Å; F622-H631 WeakPolarHBondContact CE2-CD2 3.29Å; F622-H631 AromaticContact CE2-CG 3.68Å; F622-H631 AromaticContact CE2-NE2 3.87Å; F622-H631 HydrophobicContact CZ-CB 3.58Å; F622-H631 AromaticContact CZ-CD2 3.37Å; F622-H631 WeakPolarHBondContact CZ-CD2 3.18Å; F622-H631 AromaticContact CZ-CG 3.32Å; F622-H631 AromaticContact CZ-ND1 3.89Å; F622-H631 AromaticContact CZ-NE2 3.95Å; Y627-H631 VanDerWaalsContact O-CB 3.24Å; Y627-H631 WeakPolarHBondContact O-CB 3.4Å; Y627-H631 PolarHBondContact O-N 3.4Å; L628-H631 CarbonylContact O-C 3.48Å; L628-H631 PolarHBondContact O-N 3.49Å; L628-H631 VanDerWaalsContact O-N 3.13Å; Q629-H631 VanDerWaalsContact C-N 3.27Å; Q629-H631 PolarHBondContact O-N 3.39Å; H631-I633 PolarHBondContact O-N 3.29Å; H631-I634 VanDerWaalsContact O-CB 3.23Å; H631-I634 WeakPolarHBondContact O-CB 3.42Å; H631-I634 WeakPolarHBondContact O-CG1 3.4Å; H631-I634 PolarHBondContact O-N 3.24Å; H631-H635 AromaticContact CE1-CD2 3.61Å; H631-H635 AromaticContact CE1-NE2 3.26Å; H631-H635 PolarHBondContact CE1-NE2 2.91Å; H631-H635 VanDerWaalsContact CE1-NE2 3.26Å; H631-H635 AromaticContact NE2-CD2 3.51Å; H631-H635 AromaticContact NE2-NE2 3.24Å; H631-H635 PolarHBondContact NE2-NE2 3.43Å
632	L	83.1	Confident	80.9	Confident	62 Å²	62	79.8 Å²	79.8	33%	0.325	40%	0.403	S	S	.	.	H	α-helix	trans	-62.9	-22	175.3	-73.9	168.8	0	0	0	113.1	V617 L628 Q629 I634 H635 T636	V617-L632 HydrophobicContact CG2-CD2 4.27Å; L628-L632 HydrophobicContact CD1-CD1 4.18Å; L628-L632 HydrophobicContact CD1-CG 4.07Å; L628-L632 HydrophobicContact CG-CD1 4.12Å; L628-L632 HydrophobicContact CG-CG 4.47Å; L628-L632 WeakPolarHBondContact O-CG 3.15Å; L628-L632 PolarHBondContact O-N 2.88Å; Q629-L632 PolarHBondContact O-N 3.1Å; L632-I634 VanDerWaalsContact C-N 3.26Å; L632-I634 PolarHBondContact O-N 3.21Å; L632-H635 PolarHBondContact O-N 2.99Å; L632-T636 PolarHBondContact O-N 3.43Å; L632-T636 PolarHBondContact O-OG1 3.14Å
633	I	83.1	Confident	81.1	Confident	39 Å²	39	77.7 Å²	77.7	20%	0.2	39%	0.394	C	S	.	.	H	α-helix	trans	-66	-27.9	170.5	-71.9	160.4	0	0	0	112	H631 G637 K638 A651 F652	H631-I633 PolarHBondContact O-N 3.29Å; I633-G637 PolarHBondContact O-N 2.92Å; I633-G637 VanDerWaalsContact O-N 3.14Å; I633-K638 WeakPolarHBondContact CG2-O 3.46Å; I633-A651 HydrophobicContact CG2-CB 3.57Å; I633-F652 HydrophobicContact CB-CE1 4.49Å; I633-F652 HydrophobicContact CD1-CD1 4.38Å; I633-F652 HydrophobicContact CD1-CE1 3.76Å; I633-F652 HydrophobicContact CG2-CE1 4.43Å
634	I	80.5	Confident	81	Confident	127 Å²	127	79.6 Å²	79.6	65%	0.651	41%	0.413	S	S	*	.	H	α-helix	trans	-69	-41.9	173.3	-51.3	177.6	0	0	0	110.2	H631 L632	H631-I634 VanDerWaalsContact O-CB 3.23Å; H631-I634 WeakPolarHBondContact O-CB 3.42Å; H631-I634 WeakPolarHBondContact O-CG1 3.4Å; H631-I634 PolarHBondContact O-N 3.24Å; L632-I634 VanDerWaalsContact C-N 3.26Å; L632-I634 PolarHBondContact O-N 3.21Å
635	H	80.4	Confident	80.8	Confident	75 Å²	75	81.9 Å²	81.9	35%	0.347	43%	0.427	S	S	.	.	H	α-helix	trans	-73.5	-37.1	179.8	-76.5	-67.5	0	0	0	114	V617 C618 H631 L632	V617-H635 HydrophobicContact CB-CB 4.32Å; V617-H635 HydrophobicContact CG1-CB 4.14Å; V617-H635 VanDerWaalsContact CG1-ND1 3.33Å; V617-H635 WeakPolarHBondContact CG1-ND1 3.45Å; V617-H635 HydrophobicContact CG2-CB 4.35Å; C618-H635 PolarHBondContact SG-NE2 2.99Å; H631-H635 AromaticContact CE1-CD2 3.61Å; H631-H635 AromaticContact CE1-NE2 3.26Å; H631-H635 PolarHBondContact CE1-NE2 2.91Å; H631-H635 VanDerWaalsContact CE1-NE2 3.26Å; H631-H635 AromaticContact NE2-CD2 3.51Å; H631-H635 AromaticContact NE2-NE2 3.24Å; H631-H635 PolarHBondContact NE2-NE2 3.43Å; L632-H635 PolarHBondContact O-N 2.99Å
636	T	77.4	Confident	80.8	Confident	83 Å²	83	81 Å²	81	51%	0.509	42%	0.42	S	S	.	.	H	α-helix	trans	-82.6	-13.8	179.9	52.2	0	0	0	0	113.3	L632 K638	L632-T636 PolarHBondContact O-N 3.43Å; L632-T636 PolarHBondContact O-OG1 3.14Å; T636-K638 PolarHBondContact O-N 2.78Å
637	G	76.6	Confident	80.8	Confident	51 Å²	51	80.2 Å²	80.2	53%	0.526	42%	0.422	S	S	.	.			trans	65.4	-8.6	-176.6	0	0	0	0	0	115.2	I633 K639	I633-G637 PolarHBondContact O-N 2.92Å; I633-G637 VanDerWaalsContact O-N 3.14Å; G637-K639 PolarHBondContact O-N 3.26Å; G637-K639 VanDerWaalsContact O-N 3.14Å
638	K	74.6	Confident	80.8	Confident	159 Å²	159	79.9 Å²	79.9	69%	0.691	42%	0.424	S	S	*	.			trans	-69.3	108.4	-175.3	-68.7	-175.1	179.8	-174.8	0	110	I633 T636 P640	I633-K638 WeakPolarHBondContact CG2-O 3.46Å; T636-K638 PolarHBondContact O-N 2.78Å; K638-P640 WeakPolarHBondContact O-CD 3.36Å
639	K	82.5	Confident	80.8	Confident	112 Å²	112	81.5 Å²	81.5	49%	0.487	43%	0.432	S	S	.	.			trans	-104.7	84.7	176.4	-66.8	-174.8	-159.1	168.1	0	109.8	G637 Y641 D649 F650	G637-K639 PolarHBondContact O-N 3.26Å; G637-K639 VanDerWaalsContact O-N 3.14Å; K639-Y641 PolarHBondContact O-N 2.81Å; K639-D649 HydrophobicContact CB-CB 3.78Å; K639-D649 HydrophobicContact CD-CB 3.94Å; K639-D649 WeakPolarHBondContact CD-O 3.49Å; K639-F650 CarbonylContact C-O 3.55Å; K639-F650 WeakPolarHBondContact CA-O 3.42Å; K639-F650 WeakPolarHBondContact CB-O 3.38Å
640	P	76.8	Confident	81	Confident	86 Å²	86	77 Å²	77	56%	0.558	41%	0.411	S	S	*	.			trans	-73.4	-8.8	-168.2	30.1	-37	0	0	0	114.4	K638	K638-P640 WeakPolarHBondContact O-CD 3.36Å
641	Y	81.3	Confident	81	Confident	92 Å²	92	74 Å²	74	36%	0.361	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	89.3	-175.8	-54.8	-70	0	0	0	110.9	K639 F650 L653	K639-Y641 PolarHBondContact O-N 2.81Å; Y641-F650 PolarHBondContact N-O 2.77Å; Y641-F650 WeakPolarHBondContact O-CB 3.18Å; Y641-F650 PolarHBondContact O-N 3.34Å; Y641-L653 HydrophobicContact CD1-CB 3.81Å; Y641-L653 HydrophobicContact CD1-CD1 3.62Å; Y641-L653 HydrophobicContact CD1-CG 4.3Å; Y641-L653 HydrophobicContact CD2-CB 4.27Å; Y641-L653 HydrophobicContact CE1-CB 3.72Å; Y641-L653 HydrophobicContact CE1-CD1 3.97Å; Y641-L653 HydrophobicContact CE1-CG 4.31Å; Y641-L653 HydrophobicContact CE2-CB 4.16Å; Y641-L653 VanDerWaalsContact CE2-N 3.34Å; Y641-L653 HydrophobicContact CG-CB 4.08Å; Y641-L653 HydrophobicContact CG-CD1 4.36Å
642	K	84.7	Confident	80.9	Confident	129 Å²	129	75.5 Å²	75.5	56%	0.561	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	137.4	170.9	-51.5	-160.2	160	-88.2	0	110.1	D649	K642-D649 VanDerWaalsContact CG-OD1 3.25Å; K642-D649 WeakPolarHBondContact CG-OD1 3.48Å; K642-D649 IonicContact NZ-OD1 3.44Å; K642-D649 PolarHBondContact NZ-OD1 3.28Å; K642-D649 IonicContact NZ-OD2 3.72Å; K642-D649 PolarHBondContact NZ-OD2 3.39Å
643	C	87.4	Confident	80.7	Confident	1 Å²	1	76.1 Å²	76.1	1%	0.007	41%	0.41	C	S	.	.			trans	-79.9	125.3	169.3	178.2	0	0	0	0	109.4	D645 G647 K648 F650 M656 H663	C643-D645 VanDerWaalsContact C-N 3.32Å; C643-D645 PolarHBondContact O-N 3.22Å; C643-G647 WeakPolarHBondContact O-CA 3.18Å; C643-G647 PolarHBondContact O-N 2.98Å; C643-K648 WeakPolarHBondContact CB-O 3.37Å; C643-K648 PolarHBondContact N-O 2.96Å; C643-F650 HydrophobicContact CB-CD2 4.38Å; C643-F650 HydrophobicContact CB-CE2 3.96Å; C643-M656 HydrophobicContact CB-CG 4.13Å; C643-M656 HydrophobicContact CB-SD 4.31Å; C643-H663 VanDerWaalsContact SG-CD2 3.54Å
644	P	79.1	Confident	80.6	Confident	92 Å²	92	79.7 Å²	79.7	60%	0.597	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-38.9	-177.3	24.6	-32.7	0	0	0	112.1	C646	P644-C646 VanDerWaalsContact C-N 3.29Å; P644-C646 PolarHBondContact O-N 3.2Å
645	D	75.6	Confident	80.6	Confident	83 Å²	83	77.4 Å²	77.4	44%	0.444	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-8.1	-168.2	-32.8	-58.5	0	0	0	113.9	C643 Q660 H663	C643-D645 VanDerWaalsContact C-N 3.32Å; C643-D645 PolarHBondContact O-N 3.22Å; D645-Q660 WeakPolarHBondContact OD2-CG 3.25Å; D645-Q660 PolarHBondContact OD2-NE2 3.42Å; D645-H663 HydrophobicContact CB-CB 3.67Å; D645-H663 IonicContact OD2-CD2 2.7Å
646	C	79.1	Confident	80.9	Confident	48 Å²	48	75 Å²	75	32%	0.324	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.1	8.2	-178.9	71.1	0	0	0	0	115.7	P644 K648 H659 H663	P644-C646 VanDerWaalsContact C-N 3.29Å; P644-C646 PolarHBondContact O-N 3.2Å; C646-K648 PolarHBondContact O-N 2.77Å; C646-H659 PolarHBondContact SG-NE2 3.27Å; C646-H663 VanDerWaalsContact SG-CE1 3.58Å; C646-H663 PolarHBondContact SG-NE2 3.12Å
647	G	80.8	Confident	81	Confident	50 Å²	50	77.4 Å²	77.4	52%	0.515	40%	0.404	S	S	.	.			trans	65.9	2.4	179.3	0	0	0	0	0	116.6	C643	C643-G647 WeakPolarHBondContact O-CA 3.18Å; C643-G647 PolarHBondContact O-N 2.98Å
648	K	82.1	Confident	81.2	Confident	120 Å²	120	78.6 Å²	78.6	52%	0.522	40%	0.401	S	S	.	.			trans	-71.6	132.3	-176.9	-72.7	175.4	-178.1	170.3	0	112	C643 C646 F650	C643-K648 WeakPolarHBondContact CB-O 3.37Å; C643-K648 PolarHBondContact N-O 2.96Å; C646-K648 PolarHBondContact O-N 2.77Å; K648-F650 HydrophobicContact CB-CE2 3.73Å; K648-F650 HydrophobicContact CB-CZ 4.1Å; K648-F650 WeakPolarHBondContact O-CD2 3.42Å; K648-F650 WeakPolarHBondContact O-CE2 3.23Å
649	D	84.3	Confident	81.4	Confident	60 Å²	60	72.3 Å²	72.3	32%	0.321	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	131.1	-175.9	-69.9	-2	0	0	0	112.5	K639 K642	K639-D649 HydrophobicContact CB-CB 3.78Å; K639-D649 HydrophobicContact CD-CB 3.94Å; K639-D649 WeakPolarHBondContact CD-O 3.49Å; K642-D649 VanDerWaalsContact CG-OD1 3.25Å; K642-D649 WeakPolarHBondContact CG-OD1 3.48Å; K642-D649 IonicContact NZ-OD1 3.44Å; K642-D649 PolarHBondContact NZ-OD1 3.28Å; K642-D649 IonicContact NZ-OD2 3.72Å; K642-D649 PolarHBondContact NZ-OD2 3.39Å
650	F	84.4	Confident	81.2	Confident	42 Å²	42	69.1 Å²	69.1	18%	0.184	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143.6	179.9	-64.6	-88.4	0	0	0	112.8	K639 Y641 C643 K648 F652 N655 M656 H659	K639-F650 CarbonylContact C-O 3.55Å; K639-F650 WeakPolarHBondContact CA-O 3.42Å; K639-F650 WeakPolarHBondContact CB-O 3.38Å; Y641-F650 PolarHBondContact N-O 2.77Å; Y641-F650 WeakPolarHBondContact O-CB 3.18Å; Y641-F650 PolarHBondContact O-N 3.34Å; C643-F650 HydrophobicContact CB-CD2 4.38Å; C643-F650 HydrophobicContact CB-CE2 3.96Å; K648-F650 HydrophobicContact CB-CE2 3.73Å; K648-F650 HydrophobicContact CB-CZ 4.1Å; K648-F650 WeakPolarHBondContact O-CD2 3.42Å; K648-F650 WeakPolarHBondContact O-CE2 3.23Å; F650-F652 VanDerWaalsContact C-N 3.28Å; F650-F652 PolarHBondContact O-N 2.9Å; F650-N655 HydrophobicContact CD1-CB 4.13Å; F650-M656 HydrophobicContact CB-CB 3.99Å; F650-M656 HydrophobicContact CD2-CB 3.95Å; F650-M656 HydrophobicContact CD2-CG 3.95Å; F650-M656 HydrophobicContact CG-CB 4.09Å; F650-H659 HydrophobicContact CE1-CB 4.01Å; F650-H659 HydrophobicContact CE2-CB 4.04Å; F650-H659 AromaticContact CE2-CD2 3.32Å; F650-H659 WeakPolarHBondContact CE2-CD2 3.49Å; F650-H659 AromaticContact CE2-CG 3.77Å; F650-H659 HydrophobicContact CZ-CB 3.6Å; F650-H659 AromaticContact CZ-CD2 3.24Å; F650-H659 WeakPolarHBondContact CZ-CD2 3.46Å; F650-H659 AromaticContact CZ-CG 3.27Å; F650-H659 AromaticContact CZ-ND1 3.81Å; F650-H659 AromaticContact CZ-NE2 3.76Å
651	A	82.2	Confident	81.1	Confident	23 Å²	23	70.7 Å²	70.7	19%	0.19	36%	0.359	C	S	.	.	S	Bend	trans	-65.2	-29.4	173.7	0	0	0	0	0	112.9	I633	I633-A651 HydrophobicContact CG2-CB 3.57Å
652	F	81.9	Confident	80.4	Confident	51 Å²	51	70.7 Å²	70.7	22%	0.224	37%	0.365	C	S	.	.	S	Bend	trans	-135.1	138.1	-171.8	-46.8	-56.9	0	0	0	112.4	Q630 I633 F650 Q654 N655 M656	Q630-F652 HydrophobicContact CB-CE1 4.32Å; Q630-F652 HydrophobicContact CB-CZ 4.46Å; Q630-F652 HydrophobicContact CG-CD1 4.14Å; Q630-F652 HydrophobicContact CG-CE1 3.33Å; Q630-F652 HydrophobicContact CG-CE2 4.02Å; Q630-F652 HydrophobicContact CG-CZ 3.25Å; I633-F652 HydrophobicContact CB-CE1 4.49Å; I633-F652 HydrophobicContact CD1-CD1 4.38Å; I633-F652 HydrophobicContact CD1-CE1 3.76Å; I633-F652 HydrophobicContact CG2-CE1 4.43Å; F650-F652 VanDerWaalsContact C-N 3.28Å; F650-F652 PolarHBondContact O-N 2.9Å; F652-Q654 PolarHBondContact O-N 3.33Å; F652-N655 HydrophobicContact CB-CB 4.36Å; F652-N655 PolarHBondContact O-N 3.03Å; F652-N655 VanDerWaalsContact O-N 3.07Å; F652-M656 PolarHBondContact O-N 3.49Å
653	L	79.9	Confident	79.6	Confident	76 Å²	76	67.9 Å²	67.9	40%	0.398	35%	0.354	S	S	.	.	H	α-helix	trans	-57.7	-37.4	179.4	-176.1	67.1	0	0	0	112.2	Y641 M656 R657	Y641-L653 HydrophobicContact CD1-CB 3.81Å; Y641-L653 HydrophobicContact CD1-CD1 3.62Å; Y641-L653 HydrophobicContact CD1-CG 4.3Å; Y641-L653 HydrophobicContact CD2-CB 4.27Å; Y641-L653 HydrophobicContact CE1-CB 3.72Å; Y641-L653 HydrophobicContact CE1-CD1 3.97Å; Y641-L653 HydrophobicContact CE1-CG 4.31Å; Y641-L653 HydrophobicContact CE2-CB 4.16Å; Y641-L653 VanDerWaalsContact CE2-N 3.34Å; Y641-L653 HydrophobicContact CG-CB 4.08Å; Y641-L653 HydrophobicContact CG-CD1 4.36Å; L653-M656 HydrophobicContact CD1-CE 3.91Å; L653-M656 PolarHBondContact O-N 3.49Å; L653-R657 WeakPolarHBondContact O-CB 3.5Å; L653-R657 PolarHBondContact O-N 3.45Å
654	Q	79.9	Confident	78.5	Confident	113 Å²	113	73 Å²	73	53%	0.528	38%	0.377	S	S	.	.	H	α-helix	trans	-67	-40.3	178.1	-173	65.3	1.1	0	0	111.4	F652 R657 T658	F652-Q654 PolarHBondContact O-N 3.33Å; Q654-R657 PolarHBondContact O-N 3.08Å; Q654-T658 PolarHBondContact O-N 3.26Å; Q654-T658 PolarHBondContact O-OG1 3.16Å; Q654-T658 VanDerWaalsContact O-OG1 3.1Å
655	N	82	Confident	77.3	Confident	80 Å²	80	76 Å²	76	43%	0.428	38%	0.383	S	S	.	.	H	α-helix	trans	-66.1	-41	176.3	-66.5	36.7	0	0	0	111.1	F650 F652 T658 H659	F650-N655 HydrophobicContact CD1-CB 4.13Å; F652-N655 HydrophobicContact CB-CB 4.36Å; F652-N655 PolarHBondContact O-N 3.03Å; F652-N655 VanDerWaalsContact O-N 3.07Å; N655-T658 WeakPolarHBondContact CA-OG1 2.95Å; N655-T658 PolarHBondContact O-N 3.44Å; N655-T658 PolarHBondContact O-OG1 3.24Å; N655-H659 VanDerWaalsContact O-CB 3.32Å; N655-H659 WeakPolarHBondContact O-CB 3.39Å; N655-H659 PolarHBondContact O-N 3.36Å
656	M	86.3	Confident	76.5	Confident	23 Å²	23	76.2 Å²	76.2	11%	0.113	38%	0.381	C	S	.	.	H	α-helix	trans	-58.7	-49.4	171.8	-169.1	-74.8	-72.6	0	0	110.4	C643 F650 F652 L653 T658 H659 Q660	C643-M656 HydrophobicContact CB-CG 4.13Å; C643-M656 HydrophobicContact CB-SD 4.31Å; F650-M656 HydrophobicContact CB-CB 3.99Å; F650-M656 HydrophobicContact CD2-CB 3.95Å; F650-M656 HydrophobicContact CD2-CG 3.95Å; F650-M656 HydrophobicContact CG-CB 4.09Å; F652-M656 PolarHBondContact O-N 3.49Å; L653-M656 HydrophobicContact CD1-CE 3.91Å; L653-M656 PolarHBondContact O-N 3.49Å; M656-T658 PolarHBondContact O-N 3.46Å; M656-H659 CarbonylContact O-C 3.54Å; M656-H659 WeakPolarHBondContact O-CA 3.36Å; M656-H659 WeakPolarHBondContact O-CB 3.28Å; M656-H659 PolarHBondContact O-N 3.14Å; M656-H659 VanDerWaalsContact O-N 3.08Å; M656-Q660 PolarHBondContact O-N 2.93Å; M656-Q660 HydrophobicContact SD-CB 4.48Å
657	R	80.6	Confident	75.7	Confident	135 Å²	135	78.4 Å²	78.4	51%	0.509	39%	0.394	S	S	.	.	H	α-helix	trans	-62.9	-38.9	178.5	-178.8	178.9	-78.2	159.4	-8.4	113.2	L653 Q654 H659 Q660 K661	L653-R657 WeakPolarHBondContact O-CB 3.5Å; L653-R657 PolarHBondContact O-N 3.45Å; Q654-R657 PolarHBondContact O-N 3.08Å; R657-H659 VanDerWaalsContact C-N 3.31Å; R657-Q660 WeakPolarHBondContact O-CB 3.41Å; R657-Q660 PolarHBondContact O-N 3.28Å; R657-K661 PolarHBondContact O-N 3.27Å
658	T	78.8	Confident	74.9	Confident	75 Å²	75	79.4 Å²	79.4	46%	0.46	38%	0.384	S	S	.	.	H	α-helix	trans	-69.7	-29.7	173.4	49.9	0	0	0	0	112.5	Q654 N655 M656	Q654-T658 PolarHBondContact O-N 3.26Å; Q654-T658 PolarHBondContact O-OG1 3.16Å; Q654-T658 VanDerWaalsContact O-OG1 3.1Å; N655-T658 WeakPolarHBondContact CA-OG1 2.95Å; N655-T658 PolarHBondContact O-N 3.44Å; N655-T658 PolarHBondContact O-OG1 3.24Å; M656-T658 PolarHBondContact O-N 3.46Å
659	H	79.9	Confident	74.2	Confident	28 Å²	28	81 Å²	81	13%	0.13	39%	0.387	C	S	.	.	H	α-helix	trans	-73.3	-34.5	171.6	-177.8	67.8	0	0	0	111.9	C646 F650 N655 M656 R657 K661 L662 H663	C646-H659 PolarHBondContact SG-NE2 3.27Å; F650-H659 HydrophobicContact CE1-CB 4.01Å; F650-H659 HydrophobicContact CE2-CB 4.04Å; F650-H659 AromaticContact CE2-CD2 3.32Å; F650-H659 WeakPolarHBondContact CE2-CD2 3.49Å; F650-H659 AromaticContact CE2-CG 3.77Å; F650-H659 HydrophobicContact CZ-CB 3.6Å; F650-H659 AromaticContact CZ-CD2 3.24Å; F650-H659 WeakPolarHBondContact CZ-CD2 3.46Å; F650-H659 AromaticContact CZ-CG 3.27Å; F650-H659 AromaticContact CZ-ND1 3.81Å; F650-H659 AromaticContact CZ-NE2 3.76Å; N655-H659 VanDerWaalsContact O-CB 3.32Å; N655-H659 WeakPolarHBondContact O-CB 3.39Å; N655-H659 PolarHBondContact O-N 3.36Å; M656-H659 CarbonylContact O-C 3.54Å; M656-H659 WeakPolarHBondContact O-CA 3.36Å; M656-H659 WeakPolarHBondContact O-CB 3.28Å; M656-H659 PolarHBondContact O-N 3.14Å; M656-H659 VanDerWaalsContact O-N 3.08Å; R657-H659 VanDerWaalsContact C-N 3.31Å; H659-K661 PolarHBondContact O-N 3.48Å; H659-L662 WeakPolarHBondContact O-CA 3.22Å; H659-L662 VanDerWaalsContact O-CB 3.23Å; H659-L662 WeakPolarHBondContact O-CB 3.27Å; H659-L662 PolarHBondContact O-N 2.95Å; H659-H663 AromaticContact CD2-NE2 3.39Å; H659-H663 PolarHBondContact CD2-NE2 3.4Å; H659-H663 AromaticContact CE1-NE2 3.54Å; H659-H663 AromaticContact NE2-CE1 3.74Å; H659-H663 AromaticContact NE2-NE2 2.96Å; H659-H663 PolarHBondContact NE2-NE2 3.35Å; H659-H663 PolarHBondContact O-CD2 2.8Å
660	Q	77.8	Confident	73.8	Confident	44 Å²	44	78.3 Å²	78.3	21%	0.206	37%	0.373	C	S	.	.	H	α-helix	trans	-60.3	-35.4	174.4	-144.8	-172.1	-4.3	0	0	112	D645 M656 R657 L662 H663 Q664	D645-Q660 WeakPolarHBondContact OD2-CG 3.25Å; D645-Q660 PolarHBondContact OD2-NE2 3.42Å; M656-Q660 PolarHBondContact O-N 2.93Å; M656-Q660 HydrophobicContact SD-CB 4.48Å; R657-Q660 WeakPolarHBondContact O-CB 3.41Å; R657-Q660 PolarHBondContact O-N 3.28Å; Q660-L662 PolarHBondContact O-N 2.81Å; Q660-L662 VanDerWaalsContact O-N 3.11Å; Q660-H663 PolarHBondContact O-N 3.41Å; Q660-Q664 WeakPolarHBondContact O-CG 3.48Å; Q660-Q664 PolarHBondContact O-N 2.97Å
661	K	75.6	Confident	72.9	Confident	119 Å²	119	82 Å²	82	52%	0.517	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-4.3	170.6	-68.4	-172.2	172.7	-161.1	0	115	R657 H659	R657-K661 PolarHBondContact O-N 3.27Å; H659-K661 PolarHBondContact O-N 3.48Å
662	L	66.6	Low	72.1	Confident	93 Å²	93	84.4 Å²	84.4	49%	0.487	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-20	171.2	-53	177.2	0	0	0	112.4	H659 Q660	H659-L662 WeakPolarHBondContact O-CA 3.22Å; H659-L662 VanDerWaalsContact O-CB 3.23Å; H659-L662 WeakPolarHBondContact O-CB 3.27Å; H659-L662 PolarHBondContact O-N 2.95Å; Q660-L662 PolarHBondContact O-N 2.81Å; Q660-L662 VanDerWaalsContact O-N 3.11Å
663	H	67.9	Low	71.7	Confident	70 Å²	70	84 Å²	84	32%	0.324	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-37	176.6	-57.8	-58.1	0	0	0	112.2	C643 D645 C646 H659 Q660 Q665	C643-H663 VanDerWaalsContact SG-CD2 3.54Å; D645-H663 HydrophobicContact CB-CB 3.67Å; D645-H663 IonicContact OD2-CD2 2.7Å; C646-H663 VanDerWaalsContact SG-CE1 3.58Å; C646-H663 PolarHBondContact SG-NE2 3.12Å; H659-H663 AromaticContact CD2-NE2 3.39Å; H659-H663 PolarHBondContact CD2-NE2 3.4Å; H659-H663 AromaticContact CE1-NE2 3.54Å; H659-H663 AromaticContact NE2-CE1 3.74Å; H659-H663 AromaticContact NE2-NE2 2.96Å; H659-H663 PolarHBondContact NE2-NE2 3.35Å; H659-H663 PolarHBondContact O-CD2 2.8Å; Q660-H663 PolarHBondContact O-N 3.41Å; H663-Q665 PolarHBondContact O-N 3.49Å
664	Q	63.3	Low	71.1	Confident	107 Å²	107	87.5 Å²	87.5	50%	0.5	43%	0.425	S	S	.	.	S	Bend	trans	-53.3	124.6	165	-70.5	171.5	-5.4	0	0	108.4	Q660 K666	Q660-Q664 WeakPolarHBondContact O-CG 3.48Å; Q660-Q664 PolarHBondContact O-N 2.97Å; Q664-K666 PolarHBondContact O-N 3.27Å; Q664-K666 VanDerWaalsContact O-N 3.08Å
665	Q	54.3	Low	70.7	Confident	156 Å²	156	88 Å²	88	73%	0.729	43%	0.426	S	S	*	.			trans	-53.6	120.5	-169.4	-75.4	-148.7	38.5	0	0	110.9	H663 P667	H663-Q665 PolarHBondContact O-N 3.49Å; Q665-P667 WeakPolarHBondContact O-CD 3.42Å; Q665-P667 WeakPolarHBondContact O-CG 3.27Å
666	K	60	Low	70.1	Confident	88 Å²	88	84.9 Å²	84.9	38%	0.383	41%	0.412	S	S	.	.			trans	-54.9	101.2	174.5	-73.6	157.5	154.3	-147.6	0	109.7	Q664 F668 G676 Y677	Q664-K666 PolarHBondContact O-N 3.27Å; Q664-K666 VanDerWaalsContact O-N 3.08Å; K666-F668 VanDerWaalsContact C-N 3.34Å; K666-G676 VanDerWaalsContact CD-O 3.25Å; K666-G676 WeakPolarHBondContact CD-O 3.49Å; K666-G676 VanDerWaalsContact CE-O 3.26Å; K666-G676 WeakPolarHBondContact CE-O 3.4Å; K666-G676 PolarHBondContact NZ-O 3.32Å; K666-Y677 WeakPolarHBondContact CA-O 3.41Å; K666-Y677 WeakPolarHBondContact CB-O 3.37Å
667	P	62.1	Low	69.6	Low	94 Å²	94	86.2 Å²	86.2	61%	0.61	42%	0.416	S	S	*	.			trans	-72.3	-36.2	-171.5	-14.6	30.2	0	0	0	110.7	Q665 R669	Q665-P667 WeakPolarHBondContact O-CD 3.42Å; Q665-P667 WeakPolarHBondContact O-CG 3.27Å; P667-R669 PolarHBondContact O-N 2.74Å; P667-R669 VanDerWaalsContact O-N 3.13Å
668	F	63.9	Low	69.1	Low	70 Å²	70	81.9 Å²	81.9	31%	0.307	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	86.1	-174.8	-52.1	-75.4	0	0	0	109.5	K666 Y677 S679 E680 L683	K666-F668 VanDerWaalsContact C-N 3.34Å; F668-Y677 PolarHBondContact O-N 3.02Å; F668-S679 VanDerWaalsContact CD2-C 3.46Å; F668-E680 HydrophobicContact CD1-CB 3.78Å; F668-E680 HydrophobicContact CD1-CG 4Å; F668-E680 HydrophobicContact CE1-CB 3.67Å; F668-E680 HydrophobicContact CE1-CG 4.03Å; F668-E680 HydrophobicContact CE2-CB 4.47Å; F668-E680 HydrophobicContact CG-CB 4.24Å; F668-E680 HydrophobicContact CZ-CB 4.04Å; F668-L683 HydrophobicContact CB-CB 3.93Å; F668-L683 HydrophobicContact CB-CD2 3.78Å; F668-L683 HydrophobicContact CB-CG 4.49Å
669	R	66.4	Low	68.9	Low	155 Å²	155	80.3 Å²	80.3	59%	0.585	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	135.4	172.8	-61.5	-175.8	-173	177.9	3	110.3	P667 T671 K675	P667-R669 PolarHBondContact O-N 2.74Å; P667-R669 VanDerWaalsContact O-N 3.13Å; R669-T671 PolarHBondContact O-N 3.36Å; R669-K675 WeakPolarHBondContact CA-O 3.27Å
670	C	75.1	Confident	68.7	Low	2 Å²	2	83.9 Å²	83.9	1%	0.014	42%	0.416	C	S	.	.			trans	-64.9	125.8	169.2	177	0	0	0	0	109.8	S672 C673 R674 K675 Y677 L683 M687 H690	C670-S672 VanDerWaalsContact C-N 3.34Å; C670-S672 PolarHBondContact SG-N 3.08Å; C670-S672 VanDerWaalsContact SG-N 3.38Å; C670-C673 PolarHBondContact SG-N 3.21Å; C670-C673 VanDerWaalsContact SG-N 3.36Å; C670-R674 WeakPolarHBondContact O-CA 3.3Å; C670-R674 PolarHBondContact O-N 3.42Å; C670-K675 PolarHBondContact N-O 2.65Å; C670-Y677 HydrophobicContact CB-CE2 4.4Å; C670-L683 HydrophobicContact CB-CD1 3.76Å; C670-M687 HydrophobicContact CB-SD 4.39Å; C670-H690 VanDerWaalsContact SG-CD2 3.54Å
671	T	67.2	Low	68.7	Low	121 Å²	121	86 Å²	86	74%	0.742	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-43	173.8	45.6	0	0	0	0	111.1	R669	R669-T671 PolarHBondContact O-N 3.36Å
672	S	65.5	Low	68.7	Low	73 Å²	73	83.8 Å²	83.8	51%	0.51	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-28.1	-174.4	-46.1	0	0	0	0	115.6	C670	C670-S672 VanDerWaalsContact C-N 3.34Å; C670-S672 PolarHBondContact SG-N 3.08Å; C670-S672 VanDerWaalsContact SG-N 3.38Å
673	C	73.8	Confident	69.3	Low	41 Å²	41	80.7 Å²	80.7	28%	0.277	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.3	11.5	-180	77.7	0	0	0	0	115.8	C670 K675 H686 H690	C670-C673 PolarHBondContact SG-N 3.21Å; C670-C673 VanDerWaalsContact SG-N 3.36Å; C673-K675 PolarHBondContact O-N 3.27Å; C673-K675 VanDerWaalsContact SG-CD 3.58Å; C673-K675 VanDerWaalsContact SG-CG 3.6Å; C673-H686 PolarHBondContact SG-NE2 3.45Å; C673-H690 PolarHBondContact SG-NE2 3Å
674	R	66.9	Low	69.6	Low	150 Å²	150	82.3 Å²	82.3	57%	0.566	42%	0.415	S	S	*	.			trans	58.6	1.7	176.6	-60.4	179.5	172.1	-172	-7.7	116	C670 G676 A1157 A1158	C670-R674 WeakPolarHBondContact O-CA 3.3Å; C670-R674 PolarHBondContact O-N 3.42Å; R674-G676 PolarHBondContact O-N 3.14Å; R674-A1157 PolarHBondContact NH1-O 2.76Å; R674-A1157 PolarHBondContact NH2-O 3.14Å; R674-A1158 PolarHBondContact NH1-O 2.94Å
675	K	70	Confident	70.2	Confident	125 Å²	125	81 Å²	81	54%	0.543	41%	0.408	S	S	.	.			trans	-63.7	128.1	174.2	-70.2	176	-170.1	163.3	0	110.9	R669 C670 C673 Y677	R669-K675 WeakPolarHBondContact CA-O 3.27Å; C670-K675 PolarHBondContact N-O 2.65Å; C673-K675 PolarHBondContact O-N 3.27Å; C673-K675 VanDerWaalsContact SG-CD 3.58Å; C673-K675 VanDerWaalsContact SG-CG 3.6Å; K675-Y677 HydrophobicContact CB-CE2 3.65Å; K675-Y677 WeakPolarHBondContact O-CD2 3.44Å; K675-Y677 VanDerWaalsContact O-CE2 3.22Å; K675-Y677 WeakPolarHBondContact O-CE2 3.13Å
676	G	70.2	Confident	71.5	Confident	14 Å²	14	74.5 Å²	74.5	14%	0.144	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	141.5	175.4	0	0	0	0	0	113.7	K666 R674	K666-G676 VanDerWaalsContact CD-O 3.25Å; K666-G676 WeakPolarHBondContact CD-O 3.49Å; K666-G676 VanDerWaalsContact CE-O 3.26Å; K666-G676 WeakPolarHBondContact CE-O 3.4Å; K666-G676 PolarHBondContact NZ-O 3.32Å; R674-G676 PolarHBondContact O-N 3.14Å
677	Y	75.9	Confident	72	Confident	50 Å²	50	72.3 Å²	72.3	20%	0.196	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	154.5	179.5	-65	-89.2	0	0	0	111.8	K666 F668 C670 K675 Q682 L683 H686	K666-Y677 WeakPolarHBondContact CA-O 3.41Å; K666-Y677 WeakPolarHBondContact CB-O 3.37Å; F668-Y677 PolarHBondContact O-N 3.02Å; C670-Y677 HydrophobicContact CB-CE2 4.4Å; K675-Y677 HydrophobicContact CB-CE2 3.65Å; K675-Y677 WeakPolarHBondContact O-CD2 3.44Å; K675-Y677 VanDerWaalsContact O-CE2 3.22Å; K675-Y677 WeakPolarHBondContact O-CE2 3.13Å; Y677-Q682 HydrophobicContact CD1-CB 3.95Å; Y677-Q682 HydrophobicContact CG-CB 4.34Å; Y677-L683 HydrophobicContact CD2-CB 4.35Å; Y677-L683 HydrophobicContact CD2-CD1 4.12Å; Y677-L683 HydrophobicContact CG-CB 4.44Å; Y677-H686 HydrophobicContact CE1-CB 4.16Å; Y677-H686 HydrophobicContact CE2-CB 4.31Å; Y677-H686 AromaticContact CE2-CD2 3.17Å; Y677-H686 WeakPolarHBondContact CE2-CD2 3.41Å; Y677-H686 AromaticContact CE2-CG 3.9Å; Y677-H686 AromaticContact CE2-NE2 3.84Å; Y677-H686 AromaticContact CZ-CD2 3.3Å; Y677-H686 AromaticContact CZ-CG 3.57Å; Y677-H686 AromaticContact CZ-NE2 3.92Å; Y677-H686 PolarHBondContact OH-CD2 3.48Å; Y677-H686 VanDerWaalsContact OH-CG 3.29Å; Y677-H686 PolarHBondContact OH-NE2 3.4Å
678	S	69.8	Low	72.7	Confident	44 Å²	44	70.1 Å²	70.1	31%	0.308	35%	0.353	S	S	.	.	S	Bend	trans	-88.1	-4.8	-174.4	67.9	0	0	0	0	113.9	Q682	S678-Q682 VanDerWaalsContact N-OE1 3.07Å; S678-Q682 PolarHBondContact OG-NE2 3.33Å; S678-Q682 PolarHBondContact OG-OE1 2.98Å
679	S	74.6	Confident	73.1	Confident	43 Å²	43	70.9 Å²	70.9	30%	0.301	37%	0.367	S	S	.	.	S	Bend	trans	-155.6	148.2	177.5	-176.9	0	0	0	0	109.6	F668 T681 Q682 L683	F668-S679 VanDerWaalsContact CD2-C 3.46Å; S679-T681 VanDerWaalsContact C-N 3.27Å; S679-T681 PolarHBondContact O-N 2.88Å; S679-T681 PolarHBondContact OG-OG1 2.87Å; S679-Q682 WeakPolarHBondContact O-CB 3.33Å; S679-Q682 PolarHBondContact O-N 3.41Å; S679-Q682 VanDerWaalsContact O-N 3.14Å; S679-L683 PolarHBondContact O-N 3.45Å
680	E	76.1	Confident	73.4	Confident	102 Å²	102	67.2 Å²	67.2	48%	0.477	36%	0.356	S	S	.	.	H	α-helix	trans	-56.7	-38.9	176.5	-164.4	-174.8	157.5	0	0	112.5	F668 Q682 L683 Q684	F668-E680 HydrophobicContact CD1-CB 3.78Å; F668-E680 HydrophobicContact CD1-CG 4Å; F668-E680 HydrophobicContact CE1-CB 3.67Å; F668-E680 HydrophobicContact CE1-CG 4.03Å; F668-E680 HydrophobicContact CE2-CB 4.47Å; F668-E680 HydrophobicContact CG-CB 4.24Å; F668-E680 HydrophobicContact CZ-CB 4.04Å; E680-Q682 VanDerWaalsContact C-N 3.28Å; E680-Q682 PolarHBondContact O-N 3.09Å; E680-L683 CarbonylContact O-C 3.54Å; E680-L683 WeakPolarHBondContact O-CA 3.28Å; E680-L683 WeakPolarHBondContact O-CB 3.4Å; E680-L683 PolarHBondContact O-N 3.37Å; E680-Q684 HydrophobicContact CG-CG 4.49Å; E680-Q684 WeakPolarHBondContact O-CG 3.49Å; E680-Q684 PolarHBondContact O-N 3.01Å; E680-Q684 PolarHBondContact OE1-NE2 3.46Å
681	T	77	Confident	72.9	Confident	89 Å²	89	71.9 Å²	71.9	55%	0.546	38%	0.381	S	S	.	.	H	α-helix	trans	-63.7	-33.1	178.3	56.8	0	0	0	0	112.6	S679 Q685	S679-T681 VanDerWaalsContact C-N 3.27Å; S679-T681 PolarHBondContact O-N 2.88Å; S679-T681 PolarHBondContact OG-OG1 2.87Å; T681-Q685 WeakPolarHBondContact O-CB 3.17Å; T681-Q685 PolarHBondContact O-N 2.64Å
682	Q	75.3	Confident	72.8	Confident	73 Å²	73	68.3 Å²	68.3	34%	0.341	37%	0.368	S	S	.	.	H	α-helix	trans	-71.6	-33.4	173.4	-63.8	172.5	-9.3	0	0	111.6	Y677 S678 S679 E680 H686	Y677-Q682 HydrophobicContact CD1-CB 3.95Å; Y677-Q682 HydrophobicContact CG-CB 4.34Å; S678-Q682 VanDerWaalsContact N-OE1 3.07Å; S678-Q682 PolarHBondContact OG-NE2 3.33Å; S678-Q682 PolarHBondContact OG-OE1 2.98Å; S679-Q682 WeakPolarHBondContact O-CB 3.33Å; S679-Q682 PolarHBondContact O-N 3.41Å; S679-Q682 VanDerWaalsContact O-N 3.14Å; E680-Q682 VanDerWaalsContact C-N 3.28Å; E680-Q682 PolarHBondContact O-N 3.09Å; Q682-H686 WeakPolarHBondContact O-CB 3.4Å; Q682-H686 PolarHBondContact O-N 3.47Å
683	L	79.8	Confident	72.7	Confident	27 Å²	27	68.9 Å²	68.9	14%	0.141	37%	0.365	C	S	.	.	H	α-helix	trans	-68.8	-50.5	172.2	171.8	58.6	0	0	0	110.5	F668 C670 Y677 S679 E680 Q685 H686 M687	F668-L683 HydrophobicContact CB-CB 3.93Å; F668-L683 HydrophobicContact CB-CD2 3.78Å; F668-L683 HydrophobicContact CB-CG 4.49Å; C670-L683 HydrophobicContact CB-CD1 3.76Å; Y677-L683 HydrophobicContact CD2-CB 4.35Å; Y677-L683 HydrophobicContact CD2-CD1 4.12Å; Y677-L683 HydrophobicContact CG-CB 4.44Å; S679-L683 PolarHBondContact O-N 3.45Å; E680-L683 CarbonylContact O-C 3.54Å; E680-L683 WeakPolarHBondContact O-CA 3.28Å; E680-L683 WeakPolarHBondContact O-CB 3.4Å; E680-L683 PolarHBondContact O-N 3.37Å; L683-Q685 PolarHBondContact O-N 3.07Å; L683-H686 CarbonylContact O-C 3.43Å; L683-H686 WeakPolarHBondContact O-CA 3.29Å; L683-H686 WeakPolarHBondContact O-CB 3.38Å; L683-H686 PolarHBondContact O-N 3.04Å; L683-M687 HydrophobicContact CD1-CG 3.96Å; L683-M687 HydrophobicContact CD1-SD 3.93Å; L683-M687 HydrophobicContact CG-CG 4.25Å; L683-M687 WeakPolarHBondContact O-CG 3.48Å; L683-M687 PolarHBondContact O-N 3.48Å
684	Q	75.1	Confident	72.8	Confident	104 Å²	104	72.4 Å²	72.4	49%	0.486	38%	0.376	S	S	.	.	H	α-helix	trans	-56.3	-48.3	177.1	-69.7	172.4	-4.2	0	0	111.4	E680 H686 M687 L688	E680-Q684 HydrophobicContact CG-CG 4.49Å; E680-Q684 WeakPolarHBondContact O-CG 3.49Å; E680-Q684 PolarHBondContact O-N 3.01Å; E680-Q684 PolarHBondContact OE1-NE2 3.46Å; Q684-H686 PolarHBondContact O-N 3.23Å; Q684-H686 VanDerWaalsContact O-N 3.14Å; Q684-M687 PolarHBondContact O-N 3.47Å; Q684-L688 PolarHBondContact O-N 3.22Å; Q684-L688 VanDerWaalsContact O-N 3.15Å
685	Q	76.3	Confident	73.2	Confident	79 Å²	79	69.3 Å²	69.3	37%	0.369	38%	0.375	S	S	.	.	H	α-helix	trans	-52.6	-33	172	171.2	172.9	28.2	0	0	113.4	T681 L683 L707	T681-Q685 WeakPolarHBondContact O-CB 3.17Å; T681-Q685 PolarHBondContact O-N 2.64Å; L683-Q685 PolarHBondContact O-N 3.07Å; Q685-L707 HydrophobicContact CG-CD1 3.92Å; Q685-L707 HydrophobicContact CG-CD2 3.92Å; Q685-L707 HydrophobicContact CG-CG 4.3Å; Q685-L707 VanDerWaalsContact NE2-CD1 3.27Å
686	H	79.8	Confident	73.5	Confident	21 Å²	21	66.6 Å²	66.6	10%	0.097	36%	0.364	C	S	.	.	H	α-helix	trans	-87.1	-30.3	176.5	167.7	50.6	0	0	0	113	C673 Y677 Q682 L683 Q684 L688 S689 H690	C673-H686 PolarHBondContact SG-NE2 3.45Å; Y677-H686 HydrophobicContact CE1-CB 4.16Å; Y677-H686 HydrophobicContact CE2-CB 4.31Å; Y677-H686 AromaticContact CE2-CD2 3.17Å; Y677-H686 WeakPolarHBondContact CE2-CD2 3.41Å; Y677-H686 AromaticContact CE2-CG 3.9Å; Y677-H686 AromaticContact CE2-NE2 3.84Å; Y677-H686 AromaticContact CZ-CD2 3.3Å; Y677-H686 AromaticContact CZ-CG 3.57Å; Y677-H686 AromaticContact CZ-NE2 3.92Å; Y677-H686 PolarHBondContact OH-CD2 3.48Å; Y677-H686 VanDerWaalsContact OH-CG 3.29Å; Y677-H686 PolarHBondContact OH-NE2 3.4Å; Q682-H686 WeakPolarHBondContact O-CB 3.4Å; Q682-H686 PolarHBondContact O-N 3.47Å; L683-H686 CarbonylContact O-C 3.43Å; L683-H686 WeakPolarHBondContact O-CA 3.29Å; L683-H686 WeakPolarHBondContact O-CB 3.38Å; L683-H686 PolarHBondContact O-N 3.04Å; Q684-H686 PolarHBondContact O-N 3.23Å; Q684-H686 VanDerWaalsContact O-N 3.14Å; H686-L688 PolarHBondContact O-N 3.44Å; H686-S689 PolarHBondContact ND1-OG 2.77Å; H686-S689 WeakPolarHBondContact O-CA 3.36Å; H686-S689 WeakPolarHBondContact O-CB 3.48Å; H686-S689 PolarHBondContact O-N 3.28Å; H686-S689 PolarHBondContact O-OG 3.27Å; H686-H690 AromaticContact CE1-CD2 3.43Å; H686-H690 PolarHBondContact CE1-CD2 2.75Å; H686-H690 VanDerWaalsContact CE1-CD2 3.43Å; H686-H690 AromaticContact CE1-NE2 3.22Å; H686-H690 PolarHBondContact CE1-NE2 3.14Å; H686-H690 AromaticContact NE2-CD2 3.61Å; H686-H690 AromaticContact NE2-NE2 3.43Å; H686-H690 PolarHBondContact NE2-NE2 3.48Å
687	M	71.8	Confident	73.8	Confident	41 Å²	41	73 Å²	73	20%	0.202	39%	0.388	C	S	.	.	H	α-helix	trans	-62.2	-31.2	172	-66.8	-53.1	-61.4	0	0	111.5	C670 L683 Q684 S689 H690 N691	C670-M687 HydrophobicContact CB-SD 4.39Å; L683-M687 HydrophobicContact CD1-CG 3.96Å; L683-M687 HydrophobicContact CD1-SD 3.93Å; L683-M687 HydrophobicContact CG-CG 4.25Å; L683-M687 WeakPolarHBondContact O-CG 3.48Å; L683-M687 PolarHBondContact O-N 3.48Å; Q684-M687 PolarHBondContact O-N 3.47Å; M687-S689 PolarHBondContact O-N 2.86Å; M687-S689 VanDerWaalsContact O-N 3.17Å; M687-H690 HydrophobicContact CE-CB 4.46Å; M687-H690 WeakPolarHBondContact O-CA 3.19Å; M687-H690 PolarHBondContact O-N 3.43Å; M687-N691 PolarHBondContact O-N 3.47Å; M687-N691 PolarHBondContact O-OD1 2.74Å
688	L	77	Confident	74.3	Confident	49 Å²	49	71.2 Å²	71.2	26%	0.257	38%	0.383	S	S	.	.	H	α-helix	trans	-57	-27.4	168.6	-61.8	177	0	0	0	113.2	Q684 H686 D693 G706	Q684-L688 PolarHBondContact O-N 3.22Å; Q684-L688 VanDerWaalsContact O-N 3.15Å; H686-L688 PolarHBondContact O-N 3.44Å; L688-D693 HydrophobicContact CD2-CB 3.71Å; L688-G706 WeakPolarHBondContact CD1-O 3.15Å
689	S	71.6	Confident	74.5	Confident	86 Å²	86	78.1 Å²	78.1	60%	0.601	41%	0.41	S	S	*	.	H	α-helix	trans	-82.2	-9.4	173.2	70.8	0	0	0	0	114.4	H686 M687	H686-S689 PolarHBondContact ND1-OG 2.77Å; H686-S689 WeakPolarHBondContact O-CA 3.36Å; H686-S689 WeakPolarHBondContact O-CB 3.48Å; H686-S689 PolarHBondContact O-N 3.28Å; H686-S689 PolarHBondContact O-OG 3.27Å; M687-S689 PolarHBondContact O-N 2.86Å; M687-S689 VanDerWaalsContact O-N 3.17Å
690	H	72.2	Confident	74.6	Confident	77 Å²	77	81.4 Å²	81.4	36%	0.356	42%	0.424	S	S	.	.	H	α-helix	trans	-100	-44.5	173.7	-82.8	-64.8	0	0	0	112.6	C670 C673 H686 M687 G692	C670-H690 VanDerWaalsContact SG-CD2 3.54Å; C673-H690 PolarHBondContact SG-NE2 3Å; H686-H690 AromaticContact CE1-CD2 3.43Å; H686-H690 PolarHBondContact CE1-CD2 2.75Å; H686-H690 VanDerWaalsContact CE1-CD2 3.43Å; H686-H690 AromaticContact CE1-NE2 3.22Å; H686-H690 PolarHBondContact CE1-NE2 3.14Å; H686-H690 AromaticContact NE2-CD2 3.61Å; H686-H690 AromaticContact NE2-NE2 3.43Å; H686-H690 PolarHBondContact NE2-NE2 3.48Å; M687-H690 HydrophobicContact CE-CB 4.46Å; M687-H690 WeakPolarHBondContact O-CA 3.19Å; M687-H690 PolarHBondContact O-N 3.43Å; H690-G692 PolarHBondContact O-N 2.99Å
691	N	64.1	Low	75	Confident	101 Å²	101	78.3 Å²	78.3	54%	0.54	41%	0.413	S	S	.	.	H	α-helix	trans	-69.8	-20.8	179.7	-65.4	15.3	0	0	0	113.2	M687 D693	M687-N691 PolarHBondContact O-N 3.47Å; M687-N691 PolarHBondContact O-OD1 2.74Å; N691-D693 HydrophobicContact CB-CB 4.12Å; N691-D693 WeakPolarHBondContact CB-OD2 3.4Å; N691-D693 PolarHBondContact ND2-OD2 3.12Å; N691-D693 PolarHBondContact O-N 3.13Å
692	G	66.1	Low	75	Confident	45 Å²	45	81.5 Å²	81.5	46%	0.464	43%	0.427	S	S	.	.			trans	78.6	-4.6	-168.4	0	0	0	0	0	113.9	H690 K694	H690-G692 PolarHBondContact O-N 2.99Å; G692-K694 WeakPolarHBondContact O-CD 3.46Å; G692-K694 VanDerWaalsContact O-CG 3.25Å; G692-K694 WeakPolarHBondContact O-CG 3.46Å; G692-K694 PolarHBondContact O-N 2.97Å
693	D	64.4	Low	75.2	Confident	85 Å²	85	84.2 Å²	84.2	46%	0.455	44%	0.437	S	S	.	.			trans	-56.2	104.3	175.2	-71.9	-42.5	0	0	0	111.4	L688 N691 P695	L688-D693 HydrophobicContact CD2-CB 3.71Å; N691-D693 HydrophobicContact CB-CB 4.12Å; N691-D693 WeakPolarHBondContact CB-OD2 3.4Å; N691-D693 PolarHBondContact ND2-OD2 3.12Å; N691-D693 PolarHBondContact O-N 3.13Å; D693-P695 VanDerWaalsContact C-CD 3.47Å; D693-P695 VanDerWaalsContact O-CD 3.24Å; D693-P695 WeakPolarHBondContact O-CD 3.47Å
694	K	75.2	Confident	75.2	Confident	115 Å²	115	84.2 Å²	84.2	50%	0.5	44%	0.44	S	S	.	.			trans	-118.7	74.4	-175.2	-76.4	156.3	163.8	-176.7	0	110	G692 H696 S704 F705	G692-K694 WeakPolarHBondContact O-CD 3.46Å; G692-K694 VanDerWaalsContact O-CG 3.25Å; G692-K694 WeakPolarHBondContact O-CG 3.46Å; G692-K694 PolarHBondContact O-N 2.97Å; K694-H696 PolarHBondContact O-N 3.24Å; K694-S704 WeakPolarHBondContact CD-O 3.06Å; K694-S704 WeakPolarHBondContact CE-O 3.4Å; K694-S704 WeakPolarHBondContact CG-O 3.44Å; K694-F705 CarbonylContact C-O 3.45Å; K694-F705 VanDerWaalsContact C-O 3.3Å; K694-F705 WeakPolarHBondContact CA-O 3.49Å
695	P	75.3	Confident	75.4	Confident	85 Å²	85	81.5 Å²	81.5	55%	0.552	43%	0.426	S	S	*	.			trans	-64	-21.8	-174.5	25	-35.1	0	0	0	113.7	D693 K697	D693-P695 VanDerWaalsContact C-CD 3.47Å; D693-P695 VanDerWaalsContact O-CD 3.24Å; D693-P695 WeakPolarHBondContact O-CD 3.47Å; P695-K697 PolarHBondContact O-N 3.4Å
696	H	75.1	Confident	75.4	Confident	68 Å²	68	78.6 Å²	78.6	32%	0.315	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	82.8	-178.9	-60.9	-67.5	0	0	0	110.5	K694 F705 A708 L711	K694-H696 PolarHBondContact O-N 3.24Å; H696-F705 WeakPolarHBondContact CB-O 3.37Å; H696-F705 PolarHBondContact N-O 3.34Å; H696-F705 PolarHBondContact O-N 3.09Å; H696-A708 PolarHBondContact CD2-N 2.14Å; H696-A708 PolarHBondContact NE2-N 3.18Å; H696-L711 HydrophobicContact CB-CB 3.95Å; H696-L711 HydrophobicContact CB-CD2 3.83Å; H696-L711 HydrophobicContact CB-CG 4.46Å
697	K	78.3	Confident	75.4	Confident	149 Å²	149	79.4 Å²	79.4	65%	0.648	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	151.3	173.8	-55.5	-158.4	176.2	-177.1	0	111.4	P695 S704 L711	P695-K697 PolarHBondContact O-N 3.4Å; K697-S704 WeakPolarHBondContact CG-OG 3.47Å; K697-L711 VanDerWaalsContact O-CD1 3.27Å; K697-L711 WeakPolarHBondContact O-CD1 3.17Å; K697-L711 VanDerWaalsContact O-CD2 3.3Å; K697-L711 WeakPolarHBondContact O-CD2 3.16Å
698	C	84.9	Confident	75.7	Confident	12 Å²	12	80.1 Å²	80.1	8%	0.081	44%	0.435	C	S	.	.			trans	-88.8	138	169.1	170	0	0	0	0	110	L700 C701 K703 L711 H714 M715 H718	C698-L700 VanDerWaalsContact C-N 3.33Å; C698-L700 PolarHBondContact SG-N 3.12Å; C698-C701 CarbonylContact C-O 3.55Å; C698-C701 WeakPolarHBondContact CB-O 3.49Å; C698-C701 PolarHBondContact SG-N 3.35Å; C698-K703 WeakPolarHBondContact CB-O 3.42Å; C698-K703 PolarHBondContact N-O 3.15Å; C698-L711 HydrophobicContact CB-CD1 3.82Å; C698-H714 PolarHBondContact SG-NE2 2.97Å; C698-M715 HydrophobicContact CB-CE 3.72Å; C698-M715 WeakPolarHBondContact SG-CE 3.46Å; C698-H718 PolarHBondContact SG-NE2 3.32Å
699	E	74.9	Confident	75.7	Confident	190 Å²	190	83.1 Å²	83.1	89%	0.888	44%	0.443	S	S	*	.	S	Bend	trans	-83.6	-13.9	179.5	-65.3	171.2	-177.6	0	0	112.1
700	L	76.3	Confident	76.1	Confident	112 Å²	112	82.1 Å²	82.1	59%	0.586	43%	0.431	S	S	*	.	S	Bend	trans	-107.9	-5.8	-176.3	-57.7	176	0	0	0	113.5	C698 H718	C698-L700 VanDerWaalsContact C-N 3.33Å; C698-L700 PolarHBondContact SG-N 3.12Å; L700-H718 HydrophobicContact CB-CB 4.3Å; L700-H718 HydrophobicContact CD1-CB 3.57Å
701	C	85.4	Confident	76.5	Confident	36 Å²	36	80 Å²	80	24%	0.243	42%	0.422	C	S	.	.	S	Bend	trans	-170.4	164.3	165	69.6	0	0	0	0	110.4	C698 K703 H714 H718	C698-C701 CarbonylContact C-O 3.55Å; C698-C701 WeakPolarHBondContact CB-O 3.49Å; C698-C701 PolarHBondContact SG-N 3.35Å; C701-K703 PolarHBondContact O-N 3.32Å; C701-H714 PolarHBondContact SG-NE2 2.85Å; C701-H714 VanDerWaalsContact SG-NE2 3.41Å; C701-H718 PolarHBondContact SG-CE1 2.86Å; C701-H718 PolarHBondContact SG-NE2 3.33Å
702	D	75.8	Confident	77.1	Confident	156 Å²	156	82.4 Å²	82.4	83%	0.834	42%	0.424	S	S	*	.	S	Bend	trans	-67	0.3	-173.3	-47.6	-81.3	0	0	0	116	S704	D702-S704 PolarHBondContact O-N 2.97Å; D702-S704 PolarHBondContact O-OG 3.04Å; D702-S704 VanDerWaalsContact O-OG 3.05Å
703	K	79.3	Confident	77.6	Confident	130 Å²	130	82.6 Å²	82.6	57%	0.565	41%	0.414	S	S	*	.			trans	-64.1	105.7	179.2	-68.7	175.2	-174.9	165.4	0	110.1	C698 C701 F705	C698-K703 WeakPolarHBondContact CB-O 3.42Å; C698-K703 PolarHBondContact N-O 3.15Å; C701-K703 PolarHBondContact O-N 3.32Å; K703-F705 HydrophobicContact CB-CE2 3.83Å; K703-F705 HydrophobicContact CB-CZ 4.06Å; K703-F705 WeakPolarHBondContact O-CD2 3.43Å; K703-F705 WeakPolarHBondContact O-CE2 3.37Å
704	S	79.9	Confident	78.4	Confident	28 Å²	28	79.4 Å²	79.4	20%	0.196	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	141.1	-179.5	-52.7	0	0	0	0	110.6	K694 K697 D702	K694-S704 WeakPolarHBondContact CD-O 3.06Å; K694-S704 WeakPolarHBondContact CE-O 3.4Å; K694-S704 WeakPolarHBondContact CG-O 3.44Å; K697-S704 WeakPolarHBondContact CG-OG 3.47Å; D702-S704 PolarHBondContact O-N 2.97Å; D702-S704 PolarHBondContact O-OG 3.04Å; D702-S704 VanDerWaalsContact O-OG 3.05Å
705	F	79.6	Confident	78.4	Confident	47 Å²	47	76 Å²	76	21%	0.206	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	148.8	-173.3	-60.8	-93.6	0	0	0	111.7	K694 H696 K703 L707 L710 L711 H714	K694-F705 CarbonylContact C-O 3.45Å; K694-F705 VanDerWaalsContact C-O 3.3Å; K694-F705 WeakPolarHBondContact CA-O 3.49Å; H696-F705 WeakPolarHBondContact CB-O 3.37Å; H696-F705 PolarHBondContact N-O 3.34Å; H696-F705 PolarHBondContact O-N 3.09Å; K703-F705 HydrophobicContact CB-CE2 3.83Å; K703-F705 HydrophobicContact CB-CZ 4.06Å; K703-F705 WeakPolarHBondContact O-CD2 3.43Å; K703-F705 WeakPolarHBondContact O-CE2 3.37Å; F705-L707 PolarHBondContact O-N 3.11Å; F705-L710 HydrophobicContact CB-CB 4.12Å; F705-L710 HydrophobicContact CD1-CB 3.75Å; F705-L710 HydrophobicContact CG-CB 4.15Å; F705-L711 HydrophobicContact CD2-CB 4.33Å; F705-L711 HydrophobicContact CD2-CD1 4.17Å; F705-H714 HydrophobicContact CE1-CB 4.32Å; F705-H714 HydrophobicContact CE2-CB 3.88Å; F705-H714 AromaticContact CE2-CD2 3.25Å; F705-H714 WeakPolarHBondContact CE2-CD2 3.12Å; F705-H714 AromaticContact CE2-CG 3.64Å; F705-H714 HydrophobicContact CZ-CB 3.62Å; F705-H714 AromaticContact CZ-CD2 3.58Å; F705-H714 AromaticContact CZ-CG 3.49Å; F705-H714 VanDerWaalsContact CZ-CG 3.49Å
706	G	77.5	Confident	78.6	Confident	18 Å²	18	73.5 Å²	73.5	19%	0.186	37%	0.365	C	S	.	.	S	Bend	trans	-69.2	-12.8	172.8	0	0	0	0	0	114	L688	L688-G706 WeakPolarHBondContact CD1-O 3.15Å
707	L	79.1	Confident	78.5	Confident	38 Å²	38	73.7 Å²	73.7	20%	0.199	37%	0.371	C	S	.	.	S	Bend	trans	-145.2	132.8	-166.1	-76.7	156.9	0	0	0	113.2	Q685 F705 Y709 L710 L711	Q685-L707 HydrophobicContact CG-CD1 3.92Å; Q685-L707 HydrophobicContact CG-CD2 3.92Å; Q685-L707 HydrophobicContact CG-CG 4.3Å; Q685-L707 VanDerWaalsContact NE2-CD1 3.27Å; F705-L707 PolarHBondContact O-N 3.11Å; L707-Y709 VanDerWaalsContact C-N 3.28Å; L707-Y709 HydrophobicContact CB-CD1 4.1Å; L707-Y709 HydrophobicContact CB-CE1 4Å; L707-Y709 HydrophobicContact CD1-CE1 3.78Å; L707-Y709 HydrophobicContact CD2-CD1 4.49Å; L707-Y709 HydrophobicContact CD2-CE1 4.21Å; L707-Y709 HydrophobicContact CG-CE1 4.21Å; L707-Y709 PolarHBondContact O-N 2.91Å; L707-L710 HydrophobicContact CB-CB 4.37Å; L707-L710 HydrophobicContact CB-CD1 4.1Å; L707-L710 HydrophobicContact CB-CG 4.12Å; L707-L710 HydrophobicContact CD1-CD1 4.1Å; L707-L710 WeakPolarHBondContact O-CB 3.26Å; L707-L710 PolarHBondContact O-N 2.91Å; L707-L711 PolarHBondContact O-N 3.17Å
708	A	77.9	Confident	78.4	Confident	55 Å²	55	69.8 Å²	69.8	46%	0.455	36%	0.355	S	S	.	.	H	α-helix	trans	-57.9	-34	-179.1	0	0	0	0	0	114.2	H696 L711 R712	H696-A708 PolarHBondContact CD2-N 2.14Å; H696-A708 PolarHBondContact NE2-N 3.18Å; A708-L711 PolarHBondContact O-N 2.85Å; A708-R712 PolarHBondContact O-N 3.19Å
709	Y	77.2	Confident	77.6	Confident	112 Å²	112	73 Å²	73	44%	0.439	37%	0.374	S	S	.	.	H	α-helix	trans	-72.2	-34.9	176.7	79.9	-97.7	0	0	0	112.1	L707 L711 R712 D713	L707-Y709 VanDerWaalsContact C-N 3.28Å; L707-Y709 HydrophobicContact CB-CD1 4.1Å; L707-Y709 HydrophobicContact CB-CE1 4Å; L707-Y709 HydrophobicContact CD1-CE1 3.78Å; L707-Y709 HydrophobicContact CD2-CD1 4.49Å; L707-Y709 HydrophobicContact CD2-CE1 4.21Å; L707-Y709 HydrophobicContact CG-CE1 4.21Å; L707-Y709 PolarHBondContact O-N 2.91Å; Y709-L711 VanDerWaalsContact C-N 3.33Å; Y709-R712 PolarHBondContact O-N 3.21Å; Y709-D713 VanDerWaalsContact O-CB 3.31Å; Y709-D713 WeakPolarHBondContact O-CB 3.41Å; Y709-D713 PolarHBondContact O-N 2.84Å
710	L	79.3	Confident	77.4	Confident	66 Å²	66	66.4 Å²	66.4	35%	0.346	36%	0.357	S	S	.	.	H	α-helix	trans	-67.5	-37.1	174.2	-66.7	177.8	0	0	0	111.1	F705 L707 H714	F705-L710 HydrophobicContact CB-CB 4.12Å; F705-L710 HydrophobicContact CD1-CB 3.75Å; F705-L710 HydrophobicContact CG-CB 4.15Å; L707-L710 HydrophobicContact CB-CB 4.37Å; L707-L710 HydrophobicContact CB-CD1 4.1Å; L707-L710 HydrophobicContact CB-CG 4.12Å; L707-L710 HydrophobicContact CD1-CD1 4.1Å; L707-L710 WeakPolarHBondContact O-CB 3.26Å; L707-L710 PolarHBondContact O-N 2.91Å; L710-H714 VanDerWaalsContact O-CB 3.27Å; L710-H714 WeakPolarHBondContact O-CB 3.36Å; L710-H714 PolarHBondContact O-N 3.48Å
711	L	80.3	Confident	76.9	Confident	32 Å²	32	66.4 Å²	66.4	17%	0.168	35%	0.354	C	S	.	.	H	α-helix	trans	-59.7	-51.6	170.7	174.2	63.7	0	0	0	110.9	H696 K697 C698 F705 L707 A708 Y709 D713 H714 M715	H696-L711 HydrophobicContact CB-CB 3.95Å; H696-L711 HydrophobicContact CB-CD2 3.83Å; H696-L711 HydrophobicContact CB-CG 4.46Å; K697-L711 VanDerWaalsContact O-CD1 3.27Å; K697-L711 WeakPolarHBondContact O-CD1 3.17Å; K697-L711 VanDerWaalsContact O-CD2 3.3Å; K697-L711 WeakPolarHBondContact O-CD2 3.16Å; C698-L711 HydrophobicContact CB-CD1 3.82Å; F705-L711 HydrophobicContact CD2-CB 4.33Å; F705-L711 HydrophobicContact CD2-CD1 4.17Å; L707-L711 PolarHBondContact O-N 3.17Å; A708-L711 PolarHBondContact O-N 2.85Å; Y709-L711 VanDerWaalsContact C-N 3.33Å; L711-D713 PolarHBondContact O-N 2.91Å; L711-H714 CarbonylContact O-C 2.93Å; L711-H714 WeakPolarHBondContact O-CA 3.45Å; L711-H714 WeakPolarHBondContact O-CB 3.36Å; L711-H714 PolarHBondContact O-N 3.35Å; L711-H714 VanDerWaalsContact O-N 3.09Å; L711-M715 HydrophobicContact CD1-CE 3.45Å; L711-M715 VanDerWaalsContact CD1-CE 3.45Å; L711-M715 HydrophobicContact CD1-SD 4.37Å; L711-M715 HydrophobicContact CG-CE 4.29Å; L711-M715 WeakPolarHBondContact O-CE 3.41Å; L711-M715 PolarHBondContact O-N 2.9Å
712	R	78.6	Confident	76.3	Confident	151 Å²	151	71.2 Å²	71.2	57%	0.57	37%	0.367	S	S	*	.	H	α-helix	trans	-60.9	-45.6	178.3	-174.1	-169.6	62.5	-153.9	-8.5	112.4	A708 Y709 H714 M715 N716	A708-R712 PolarHBondContact O-N 3.19Å; Y709-R712 PolarHBondContact O-N 3.21Å; R712-H714 PolarHBondContact O-N 2.95Å; R712-H714 VanDerWaalsContact O-N 3.17Å; R712-M715 WeakPolarHBondContact O-CB 3.36Å; R712-M715 PolarHBondContact O-N 3.28Å; R712-N716 PolarHBondContact O-N 2.84Å; R712-N716 PolarHBondContact O-OD1 2.9Å
713	D	74.9	Confident	76.2	Confident	50 Å²	50	67.6 Å²	67.6	27%	0.267	35%	0.352	S	S	.	.	H	α-helix	trans	-66.7	-16.3	178.7	-61.2	-5.4	0	0	0	112	Y709 L711 W735	Y709-D713 VanDerWaalsContact O-CB 3.31Å; Y709-D713 WeakPolarHBondContact O-CB 3.41Å; Y709-D713 PolarHBondContact O-N 2.84Å; L711-D713 PolarHBondContact O-N 2.91Å; D713-W735 PolarHBondContact O-NE1 2.89Å
714	H	81.6	Confident	76	Confident	17 Å²	17	64.3 Å²	64.3	8%	0.079	34%	0.339	C	S	.	.	H	α-helix	trans	-88.2	-29.8	167.2	171.4	53.2	0	0	0	113.7	C698 C701 F705 L710 L711 R712 N716 T717 H718	C698-H714 PolarHBondContact SG-NE2 2.97Å; C701-H714 PolarHBondContact SG-NE2 2.85Å; C701-H714 VanDerWaalsContact SG-NE2 3.41Å; F705-H714 HydrophobicContact CE1-CB 4.32Å; F705-H714 HydrophobicContact CE2-CB 3.88Å; F705-H714 AromaticContact CE2-CD2 3.25Å; F705-H714 WeakPolarHBondContact CE2-CD2 3.12Å; F705-H714 AromaticContact CE2-CG 3.64Å; F705-H714 HydrophobicContact CZ-CB 3.62Å; F705-H714 AromaticContact CZ-CD2 3.58Å; F705-H714 AromaticContact CZ-CG 3.49Å; F705-H714 VanDerWaalsContact CZ-CG 3.49Å; L710-H714 VanDerWaalsContact O-CB 3.27Å; L710-H714 WeakPolarHBondContact O-CB 3.36Å; L710-H714 PolarHBondContact O-N 3.48Å; L711-H714 CarbonylContact O-C 2.93Å; L711-H714 WeakPolarHBondContact O-CA 3.45Å; L711-H714 WeakPolarHBondContact O-CB 3.36Å; L711-H714 PolarHBondContact O-N 3.35Å; L711-H714 VanDerWaalsContact O-N 3.09Å; R712-H714 PolarHBondContact O-N 2.95Å; R712-H714 VanDerWaalsContact O-N 3.17Å; H714-N716 PolarHBondContact O-N 3.29Å; H714-T717 PolarHBondContact CE1-OG1 3.23Å; H714-T717 PolarHBondContact ND1-OG1 3.09Å; H714-T717 WeakPolarHBondContact O-CA 3.46Å; H714-T717 WeakPolarHBondContact O-CB 3.26Å; H714-T717 PolarHBondContact O-N 3.29Å; H714-T717 PolarHBondContact O-OG1 2.95Å; H714-H718 AromaticContact CE1-CD2 3.63Å; H714-H718 AromaticContact CE1-NE2 3.14Å; H714-H718 PolarHBondContact CE1-NE2 3.47Å; H714-H718 AromaticContact NE2-CD2 3.59Å; H714-H718 AromaticContact NE2-NE2 3.02Å; H714-H718 PolarHBondContact NE2-NE2 3.22Å
715	M	75.4	Confident	75.9	Confident	45 Å²	45	69.1 Å²	69.1	22%	0.222	35%	0.353	C	S	.	.	H	α-helix	trans	-57	-38.3	172.1	-64	-54.4	86.7	0	0	111	C698 L711 R712 T717 H718 T719	C698-M715 HydrophobicContact CB-CE 3.72Å; C698-M715 WeakPolarHBondContact SG-CE 3.46Å; L711-M715 HydrophobicContact CD1-CE 3.45Å; L711-M715 VanDerWaalsContact CD1-CE 3.45Å; L711-M715 HydrophobicContact CD1-SD 4.37Å; L711-M715 HydrophobicContact CG-CE 4.29Å; L711-M715 WeakPolarHBondContact O-CE 3.41Å; L711-M715 PolarHBondContact O-N 2.9Å; R712-M715 WeakPolarHBondContact O-CB 3.36Å; R712-M715 PolarHBondContact O-N 3.28Å; M715-T717 PolarHBondContact O-N 3.25Å; M715-H718 PolarHBondContact O-N 2.81Å; M715-T719 PolarHBondContact O-N 3.38Å; M715-T719 PolarHBondContact O-OG1 3.19Å
716	N	78.4	Confident	76.3	Confident	31 Å²	31	67 Å²	67	17%	0.166	34%	0.343	C	S	.	.	H	α-helix	trans	-56	-18.8	172.4	-59	7	0	0	0	113.9	R712 H714 E721	R712-N716 PolarHBondContact O-N 2.84Å; R712-N716 PolarHBondContact O-OD1 2.9Å; H714-N716 PolarHBondContact O-N 3.29Å; N716-E721 PolarHBondContact O-N 3.19Å
717	T	74.6	Confident	76.3	Confident	72 Å²	72	74 Å²	74	44%	0.442	37%	0.371	S	S	.	.	H	α-helix	trans	-87.8	-15.6	175.7	68.7	0	0	0	0	113.6	H714 M715 W735	H714-T717 PolarHBondContact CE1-OG1 3.23Å; H714-T717 PolarHBondContact ND1-OG1 3.09Å; H714-T717 WeakPolarHBondContact O-CA 3.46Å; H714-T717 WeakPolarHBondContact O-CB 3.26Å; H714-T717 PolarHBondContact O-N 3.29Å; H714-T717 PolarHBondContact O-OG1 2.95Å; M715-T717 PolarHBondContact O-N 3.25Å; T717-W735 HydrophobicContact CG2-CZ2 4.44Å
718	H	76	Confident	76.3	Confident	68 Å²	68	76.7 Å²	76.7	32%	0.315	38%	0.383	S	S	.	.	H	α-helix	trans	-96.2	-44.5	173.5	-69.8	-73.7	0	0	0	112.4	C698 L700 C701 H714 M715 G720	C698-H718 PolarHBondContact SG-NE2 3.32Å; L700-H718 HydrophobicContact CB-CB 4.3Å; L700-H718 HydrophobicContact CD1-CB 3.57Å; C701-H718 PolarHBondContact SG-CE1 2.86Å; C701-H718 PolarHBondContact SG-NE2 3.33Å; H714-H718 AromaticContact CE1-CD2 3.63Å; H714-H718 AromaticContact CE1-NE2 3.14Å; H714-H718 PolarHBondContact CE1-NE2 3.47Å; H714-H718 AromaticContact NE2-CD2 3.59Å; H714-H718 AromaticContact NE2-NE2 3.02Å; H714-H718 PolarHBondContact NE2-NE2 3.22Å; M715-H718 PolarHBondContact O-N 2.81Å; H718-G720 PolarHBondContact O-N 3.3Å; H718-G720 VanDerWaalsContact O-N 3.13Å
719	T	68.6	Low	76.6	Confident	78 Å²	78	76.4 Å²	76.4	48%	0.479	38%	0.377	S	S	.	.	S	Bend	trans	-68.3	-9.3	177.1	59.2	0	0	0	0	112.9	M715 E721	M715-T719 PolarHBondContact O-N 3.38Å; M715-T719 PolarHBondContact O-OG1 3.19Å; T719-E721 PolarHBondContact O-N 2.84Å; T719-E721 VanDerWaalsContact O-N 3.08Å; T719-E721 WeakPolarHBondContact OG1-CB 3.25Å; T719-E721 WeakPolarHBondContact OG1-CG 3.47Å; T719-E721 PolarHBondContact OG1-N 3.05Å
720	G	70.6	Confident	76.7	Confident	52 Å²	52	75.2 Å²	75.2	54%	0.536	38%	0.375	S	S	.	.			trans	65.9	4.3	-172.2	0	0	0	0	0	113.5	H718 R722	H718-G720 PolarHBondContact O-N 3.3Å; H718-G720 VanDerWaalsContact O-N 3.13Å; G720-R722 WeakPolarHBondContact O-CG 3.3Å; G720-R722 PolarHBondContact O-N 2.97Å
721	E	65.9	Low	76.9	Confident	113 Å²	113	78.4 Å²	78.4	53%	0.528	39%	0.386	S	S	.	.			trans	-65.7	122.9	-176.5	-75.9	-176.2	-167.3	0	0	110.8	N716 T719 P723	N716-E721 PolarHBondContact O-N 3.19Å; T719-E721 PolarHBondContact O-N 2.84Å; T719-E721 VanDerWaalsContact O-N 3.08Å; T719-E721 WeakPolarHBondContact OG1-CB 3.25Å; T719-E721 WeakPolarHBondContact OG1-CG 3.47Å; T719-E721 PolarHBondContact OG1-N 3.05Å; E721-P723 HydrophobicContact CB-CG 4.48Å; E721-P723 WeakPolarHBondContact O-CD 3.39Å
722	R	71.8	Confident	76.9	Confident	137 Å²	137	78.4 Å²	78.4	52%	0.517	39%	0.389	S	S	.	.			trans	-125.7	70.1	178.7	-65.6	168.9	80.1	108.9	2	108.1	G720 H724 S732 F733	G720-R722 WeakPolarHBondContact O-CG 3.3Å; G720-R722 PolarHBondContact O-N 2.97Å; R722-H724 PolarHBondContact O-N 2.91Å; R722-S732 VanDerWaalsContact CZ-O 3.29Å; R722-S732 PolarHBondContact NE-O 3.05Å; R722-S732 PolarHBondContact NH2-O 2.79Å; R722-S732 WeakPolarHBondContact O-CB 3.25Å; R722-F733 CarbonylContact C-O 3.59Å; R722-F733 VanDerWaalsContact CA-O 3.26Å; R722-F733 WeakPolarHBondContact CA-O 3.31Å
723	P	73.1	Confident	76.9	Confident	80 Å²	80	73 Å²	73	52%	0.519	37%	0.369	S	S	.	.			trans	-65	-17	-166.2	-20.4	34.1	0	0	0	113.3	E721 R725	E721-P723 HydrophobicContact CB-CG 4.48Å; E721-P723 WeakPolarHBondContact O-CD 3.39Å; P723-R725 PolarHBondContact O-N 3.14Å
724	H	75	Confident	76.8	Confident	61 Å²	61	71.3 Å²	71.3	28%	0.282	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	79.8	-173.9	-57.8	-55.1	0	0	0	110.2	R722 F733 F736 L739	R722-H724 PolarHBondContact O-N 2.91Å; H724-F733 HydrophobicContact CB-CB 4.49Å; H724-F733 PolarHBondContact N-O 3.21Å; H724-F733 PolarHBondContact O-N 3.06Å; H724-F736 PolarHBondContact CD2-N 3.32Å; H724-F736 AromaticContact ND1-CD2 3.77Å; H724-L739 HydrophobicContact CB-CB 3.94Å; H724-L739 HydrophobicContact CB-CD2 3.74Å; H724-L739 HydrophobicContact CB-CG 4.45Å
725	R	79	Confident	76.6	Confident	129 Å²	129	76 Å²	76	49%	0.487	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	137.2	174.1	-167.7	175.6	-177.3	95.1	-21.1	111.4	P723 H730 S732	P723-R725 PolarHBondContact O-N 3.14Å; R725-H730 VanDerWaalsContact CZ-O 3.31Å; R725-H730 PolarHBondContact NH1-O 3.29Å; R725-S732 PolarHBondContact NH1-OG 2.93Å
726	C	87.1	Confident	76.5	Confident	1 Å²	1	79.5 Å²	79.5	1%	0.007	39%	0.393	C	S	.	.			trans	-77.2	129.1	171	-172.2	0	0	0	0	111	H730 K731 F733 L739 H746	C726-H730 WeakPolarHBondContact O-CA 3.32Å; C726-H730 PolarHBondContact O-N 2.69Å; C726-H730 PolarHBondContact O-ND1 2.96Å; C726-K731 WeakPolarHBondContact CB-O 3.46Å; C726-K731 PolarHBondContact N-O 3.35Å; C726-F733 HydrophobicContact CB-CE2 4.46Å; C726-L739 HydrophobicContact CB-CD1 3.7Å; C726-H746 VanDerWaalsContact SG-CD2 3.55Å; C726-H746 PolarHBondContact SG-NE2 3.46Å
727	E	78.6	Confident	76.5	Confident	165 Å²	165	81.7 Å²	81.7	77%	0.771	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-38.6	174.9	-66.6	172.3	174.2	0	0	111.6	H730	E727-H730 PolarHBondContact O-CE1 3.12Å; E727-H730 PolarHBondContact O-ND1 3.12Å
728	E	78.9	Confident	76.8	Confident	96 Å²	96	80.1 Å²	80.1	45%	0.449	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-19	-173.5	-65.9	-175	116.4	0	0	115.4	H746 K750	E728-H746 WeakPolarHBondContact OE2-CB 3.39Å; E728-H746 IonicContact OE2-CD2 3.81Å; E728-H746 IonicContact OE2-CG 3.99Å; E728-K750 IonicContact OE1-NZ 3.25Å; E728-K750 PolarHBondContact OE1-NZ 2.89Å
729	C	84.8	Confident	77.3	Confident	48 Å²	48	77.4 Å²	77.4	32%	0.324	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.9	14.3	172.9	83	0	0	0	0	115.7	K731 H742 H746	C729-K731 PolarHBondContact O-N 2.88Å; C729-H742 PolarHBondContact SG-NE2 3.23Å; C729-H746 PolarHBondContact SG-CE1 2.75Å; C729-H746 PolarHBondContact SG-NE2 3.3Å
730	H	79.2	Confident	78.1	Confident	88 Å²	88	77.4 Å²	77.4	41%	0.407	39%	0.387	S	S	.	.			trans	61.1	3.7	170.9	-62.5	-19.3	0	0	0	117.7	R725 C726 E727 S732	R725-H730 VanDerWaalsContact CZ-O 3.31Å; R725-H730 PolarHBondContact NH1-O 3.29Å; C726-H730 WeakPolarHBondContact O-CA 3.32Å; C726-H730 PolarHBondContact O-N 2.69Å; C726-H730 PolarHBondContact O-ND1 2.96Å; E727-H730 PolarHBondContact O-CE1 3.12Å; E727-H730 PolarHBondContact O-ND1 3.12Å; H730-S732 PolarHBondContact O-N 3.2Å
731	K	81.6	Confident	78.7	Confident	133 Å²	133	79.2 Å²	79.2	58%	0.578	39%	0.388	S	S	*	.			trans	-61.9	125.4	168.3	-66.9	-174.7	-178.8	-168.5	0	110.1	C726 C729 F733	C726-K731 WeakPolarHBondContact CB-O 3.46Å; C726-K731 PolarHBondContact N-O 3.35Å; C729-K731 PolarHBondContact O-N 2.88Å; K731-F733 HydrophobicContact CB-CE2 3.8Å; K731-F733 HydrophobicContact CB-CZ 3.93Å; K731-F733 WeakPolarHBondContact O-CD2 3.49Å; K731-F733 VanDerWaalsContact O-CE2 3.26Å; K731-F733 WeakPolarHBondContact O-CE2 3.38Å
732	S	80.8	Confident	79.6	Confident	32 Å²	32	75 Å²	75	22%	0.224	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	142.2	176.7	-58	0	0	0	0	111.4	R722 R725 H730	R722-S732 VanDerWaalsContact CZ-O 3.29Å; R722-S732 PolarHBondContact NE-O 3.05Å; R722-S732 PolarHBondContact NH2-O 2.79Å; R722-S732 WeakPolarHBondContact O-CB 3.25Å; R725-S732 PolarHBondContact NH1-OG 2.93Å; H730-S732 PolarHBondContact O-N 3.2Å
733	F	79	Confident	80.2	Confident	36 Å²	36	71.4 Å²	71.4	16%	0.158	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	143.1	-179.4	-61	-89.7	0	0	0	111.4	R722 H724 C726 K731 W735 L739 H742	R722-F733 CarbonylContact C-O 3.59Å; R722-F733 VanDerWaalsContact CA-O 3.26Å; R722-F733 WeakPolarHBondContact CA-O 3.31Å; H724-F733 HydrophobicContact CB-CB 4.49Å; H724-F733 PolarHBondContact N-O 3.21Å; H724-F733 PolarHBondContact O-N 3.06Å; C726-F733 HydrophobicContact CB-CE2 4.46Å; K731-F733 HydrophobicContact CB-CE2 3.8Å; K731-F733 HydrophobicContact CB-CZ 3.93Å; K731-F733 WeakPolarHBondContact O-CD2 3.49Å; K731-F733 VanDerWaalsContact O-CE2 3.26Å; K731-F733 WeakPolarHBondContact O-CE2 3.38Å; F733-W735 PolarHBondContact O-N 3.41Å; F733-L739 HydrophobicContact CB-CB 4.41Å; F733-L739 HydrophobicContact CD2-CB 4.1Å; F733-L739 HydrophobicContact CD2-CD1 4.07Å; F733-L739 HydrophobicContact CE2-CD1 4.34Å; F733-L739 HydrophobicContact CG-CB 4.45Å; F733-H742 HydrophobicContact CE1-CB 4.23Å; F733-H742 HydrophobicContact CE2-CB 3.98Å; F733-H742 AromaticContact CE2-CD2 3.3Å; F733-H742 WeakPolarHBondContact CE2-CD2 3.48Å; F733-H742 AromaticContact CE2-CG 3.66Å; F733-H742 AromaticContact CE2-NE2 3.93Å; F733-H742 HydrophobicContact CZ-CB 3.66Å; F733-H742 AromaticContact CZ-CD2 3.43Å; F733-H742 VanDerWaalsContact CZ-CD2 3.43Å; F733-H742 WeakPolarHBondContact CZ-CD2 3.47Å; F733-H742 AromaticContact CZ-CG 3.34Å; F733-H742 AromaticContact CZ-ND1 3.79Å; F733-H742 AromaticContact CZ-NE2 3.91Å
734	S	72.6	Confident	80.8	Confident	16 Å²	16	73.6 Å²	73.6	11%	0.112	36%	0.359	C	S	.	.	S	Bend	trans	-65	-26	172.7	43.3	0	0	0	0	112.8
735	W	76.8	Confident	81.1	Confident	114 Å²	114	75.3 Å²	75.3	43%	0.432	37%	0.369	S	S	.	.	S	Bend	trans	-131.6	137	-174.3	-49.1	-55.2	0	0	0	112.3	D713 T717 F733 S737 S738 L739	D713-W735 PolarHBondContact O-NE1 2.89Å; T717-W735 HydrophobicContact CG2-CZ2 4.44Å; F733-W735 PolarHBondContact O-N 3.41Å; W735-S737 VanDerWaalsContact C-N 3.26Å; W735-S737 PolarHBondContact O-N 3.39Å; W735-S738 PolarHBondContact O-N 3.44Å; W735-L739 PolarHBondContact O-N 3.27Å; W735-L739 VanDerWaalsContact O-N 3.17Å
736	F	74.4	Confident	81.3	Confident	119 Å²	119	70.7 Å²	70.7	52%	0.522	35%	0.353	S	S	.	.	H	α-helix	trans	-63.1	-31.6	178.2	-176.1	-100.8	0	0	0	112.8	H724 L739 L740	H724-F736 PolarHBondContact CD2-N 3.32Å; H724-F736 AromaticContact ND1-CD2 3.77Å; F736-L739 HydrophobicContact CD2-CD2 4.38Å; F736-L739 HydrophobicContact CE2-CD2 4.49Å; F736-L739 PolarHBondContact O-N 3.08Å; F736-L740 WeakPolarHBondContact O-CB 3.36Å; F736-L740 PolarHBondContact O-N 3.22Å
737	S	77.5	Confident	80.8	Confident	77 Å²	77	73 Å²	73	54%	0.538	37%	0.371	S	S	.	.	H	α-helix	trans	-59.3	-45	173.3	47.9	0	0	0	0	111.9	W735 L740 V741	W735-S737 VanDerWaalsContact C-N 3.26Å; W735-S737 PolarHBondContact O-N 3.39Å; S737-L740 PolarHBondContact O-N 2.72Å; S737-V741 WeakPolarHBondContact O-CG2 3.43Å; S737-V741 PolarHBondContact O-N 3.09Å
738	S	82.4	Confident	80.6	Confident	39 Å²	39	74.2 Å²	74.2	27%	0.273	37%	0.369	S	S	.	.	H	α-helix	trans	-66.4	-39.7	175.6	-58.4	0	0	0	0	112.2	W735 L740 V741 H742	W735-S738 PolarHBondContact O-N 3.44Å; S738-L740 VanDerWaalsContact C-N 3.34Å; S738-L740 PolarHBondContact O-N 2.64Å; S738-V741 PolarHBondContact O-N 3.44Å; S738-H742 WeakPolarHBondContact O-CB 3.33Å; S738-H742 PolarHBondContact O-N 2.85Å
739	L	85.9	Confident	80.2	Confident	11 Å²	11	77.2 Å²	77.2	6%	0.058	38%	0.38	C	S	.	.	H	α-helix	trans	-59.4	-44.3	171.4	173.1	61.8	0	0	0	111.5	H724 C726 F733 W735 F736 H742 Q743	H724-L739 HydrophobicContact CB-CB 3.94Å; H724-L739 HydrophobicContact CB-CD2 3.74Å; H724-L739 HydrophobicContact CB-CG 4.45Å; C726-L739 HydrophobicContact CB-CD1 3.7Å; F733-L739 HydrophobicContact CB-CB 4.41Å; F733-L739 HydrophobicContact CD2-CB 4.1Å; F733-L739 HydrophobicContact CD2-CD1 4.07Å; F733-L739 HydrophobicContact CE2-CD1 4.34Å; F733-L739 HydrophobicContact CG-CB 4.45Å; W735-L739 PolarHBondContact O-N 3.27Å; W735-L739 VanDerWaalsContact O-N 3.17Å; F736-L739 HydrophobicContact CD2-CD2 4.38Å; F736-L739 HydrophobicContact CE2-CD2 4.49Å; F736-L739 PolarHBondContact O-N 3.08Å; L739-H742 CarbonylContact O-C 3.55Å; L739-H742 WeakPolarHBondContact O-CB 3.35Å; L739-H742 PolarHBondContact O-N 3.25Å; L739-Q743 HydrophobicContact CD1-CG 4.1Å; L739-Q743 HydrophobicContact CG-CG 4.5Å; L739-Q743 WeakPolarHBondContact O-CG 3.43Å; L739-Q743 PolarHBondContact O-N 2.96Å
740	L	84.5	Confident	79.2	Confident	78 Å²	78	81.6 Å²	81.6	41%	0.408	39%	0.394	S	S	.	.	H	α-helix	trans	-69	-36.3	-178.8	-175.9	63.7	0	0	0	112.7	F736 S737 S738 K744	F736-L740 WeakPolarHBondContact O-CB 3.36Å; F736-L740 PolarHBondContact O-N 3.22Å; S737-L740 PolarHBondContact O-N 2.72Å; S738-L740 VanDerWaalsContact C-N 3.34Å; S738-L740 PolarHBondContact O-N 2.64Å; L740-K744 WeakPolarHBondContact O-CG 3.5Å; L740-K744 PolarHBondContact O-N 3.05Å
741	V	83.6	Confident	78.3	Confident	91 Å²	91	84.2 Å²	84.2	55%	0.552	41%	0.407	S	S	*	.	H	α-helix	trans	-65.2	-42.4	170.1	170.6	0	0	0	0	110.3	S737 S738 K744 I745	S737-V741 WeakPolarHBondContact O-CG2 3.43Å; S737-V741 PolarHBondContact O-N 3.09Å; S738-V741 PolarHBondContact O-N 3.44Å; V741-K744 WeakPolarHBondContact O-CB 3.48Å; V741-K744 PolarHBondContact O-N 3.48Å; V741-K744 VanDerWaalsContact O-N 3.16Å; V741-I745 PolarHBondContact O-N 3.41Å
742	H	84.8	Confident	77	Confident	23 Å²	23	80.6 Å²	80.6	11%	0.106	41%	0.406	C	S	.	.	H	α-helix	trans	-66	-40.5	178.7	177.3	65.1	0	0	0	113.2	C729 F733 S738 L739 K744 I745 H746	C729-H742 PolarHBondContact SG-NE2 3.23Å; F733-H742 HydrophobicContact CE1-CB 4.23Å; F733-H742 HydrophobicContact CE2-CB 3.98Å; F733-H742 AromaticContact CE2-CD2 3.3Å; F733-H742 WeakPolarHBondContact CE2-CD2 3.48Å; F733-H742 AromaticContact CE2-CG 3.66Å; F733-H742 AromaticContact CE2-NE2 3.93Å; F733-H742 HydrophobicContact CZ-CB 3.66Å; F733-H742 AromaticContact CZ-CD2 3.43Å; F733-H742 VanDerWaalsContact CZ-CD2 3.43Å; F733-H742 WeakPolarHBondContact CZ-CD2 3.47Å; F733-H742 AromaticContact CZ-CG 3.34Å; F733-H742 AromaticContact CZ-ND1 3.79Å; F733-H742 AromaticContact CZ-NE2 3.91Å; S738-H742 WeakPolarHBondContact O-CB 3.33Å; S738-H742 PolarHBondContact O-N 2.85Å; L739-H742 CarbonylContact O-C 3.55Å; L739-H742 WeakPolarHBondContact O-CB 3.35Å; L739-H742 PolarHBondContact O-N 3.25Å; H742-K744 PolarHBondContact O-N 3.23Å; H742-I745 WeakPolarHBondContact O-CA 3.27Å; H742-I745 VanDerWaalsContact O-CB 3.31Å; H742-I745 WeakPolarHBondContact O-CB 3.15Å; H742-I745 PolarHBondContact O-N 3.1Å; H742-H746 AromaticContact CD2-NE2 3.69Å; H742-H746 AromaticContact CE1-CE1 3.81Å; H742-H746 AromaticContact CE1-NE2 3.39Å; H742-H746 PolarHBondContact CE1-NE2 2.82Å; H742-H746 AromaticContact NE2-CD2 3.87Å; H742-H746 AromaticContact NE2-CE1 3.81Å; H742-H746 AromaticContact NE2-NE2 2.99Å; H742-H746 PolarHBondContact NE2-NE2 3.21Å; H742-H746 PolarHBondContact O-N 3.28Å
743	Q	84.9	Confident	75.4	Confident	62 Å²	62	86.4 Å²	86.4	29%	0.29	43%	0.434	S	S	.	.	H	α-helix	trans	-60.9	-31.5	171.7	-77.9	177.6	-33.7	0	0	112.4	L739 I745 H746 A747	L739-Q743 HydrophobicContact CD1-CG 4.1Å; L739-Q743 HydrophobicContact CG-CG 4.5Å; L739-Q743 WeakPolarHBondContact O-CG 3.43Å; L739-Q743 PolarHBondContact O-N 2.96Å; Q743-I745 VanDerWaalsContact C-N 3.29Å; Q743-I745 PolarHBondContact O-N 3.23Å; Q743-H746 PolarHBondContact O-N 3.45Å; Q743-A747 PolarHBondContact O-N 2.69Å
744	K	84.5	Confident	73.9	Confident	127 Å²	127	89.5 Å²	89.5	55%	0.552	46%	0.461	S	S	*	.	H	α-helix	trans	-68.3	-26.6	171.8	-69.4	172.3	-178.3	-179.4	0	113	L740 V741 H742 R748	L740-K744 WeakPolarHBondContact O-CG 3.5Å; L740-K744 PolarHBondContact O-N 3.05Å; V741-K744 WeakPolarHBondContact O-CB 3.48Å; V741-K744 PolarHBondContact O-N 3.48Å; V741-K744 VanDerWaalsContact O-N 3.16Å; H742-K744 PolarHBondContact O-N 3.23Å; K744-R748 WeakPolarHBondContact O-CB 3.25Å; K744-R748 WeakPolarHBondContact O-CG 3.34Å; K744-R748 PolarHBondContact O-N 2.87Å
745	I	82.9	Confident	72.7	Confident	96 Å²	96	96.9 Å²	96.9	49%	0.492	49%	0.493	S	S	.	.	H	α-helix	trans	-68.7	-43.5	172.6	-57.5	172.1	0	0	0	109.7	V741 H742 Q743 R748 K749	V741-I745 PolarHBondContact O-N 3.41Å; H742-I745 WeakPolarHBondContact O-CA 3.27Å; H742-I745 VanDerWaalsContact O-CB 3.31Å; H742-I745 WeakPolarHBondContact O-CB 3.15Å; H742-I745 PolarHBondContact O-N 3.1Å; Q743-I745 VanDerWaalsContact C-N 3.29Å; Q743-I745 PolarHBondContact O-N 3.23Å; I745-R748 PolarHBondContact O-N 3.34Å; I745-K749 WeakPolarHBondContact O-CB 3.24Å; I745-K749 PolarHBondContact O-N 3.48Å
746	H	81.9	Confident	71	Confident	33 Å²	33	100.6 Å²	100.6	15%	0.153	51%	0.508	C	S	.	.	H	α-helix	trans	-61.8	-47.2	173	-65.2	-46.3	0	0	0	111.8	C726 E728 C729 H742 Q743 R748 K749 K750	C726-H746 VanDerWaalsContact SG-CD2 3.55Å; C726-H746 PolarHBondContact SG-NE2 3.46Å; E728-H746 WeakPolarHBondContact OE2-CB 3.39Å; E728-H746 IonicContact OE2-CD2 3.81Å; E728-H746 IonicContact OE2-CG 3.99Å; C729-H746 PolarHBondContact SG-CE1 2.75Å; C729-H746 PolarHBondContact SG-NE2 3.3Å; H742-H746 AromaticContact CD2-NE2 3.69Å; H742-H746 AromaticContact CE1-CE1 3.81Å; H742-H746 AromaticContact CE1-NE2 3.39Å; H742-H746 PolarHBondContact CE1-NE2 2.82Å; H742-H746 AromaticContact NE2-CD2 3.87Å; H742-H746 AromaticContact NE2-CE1 3.81Å; H742-H746 AromaticContact NE2-NE2 2.99Å; H742-H746 PolarHBondContact NE2-NE2 3.21Å; H742-H746 PolarHBondContact O-N 3.28Å; Q743-H746 PolarHBondContact O-N 3.45Å; H746-R748 VanDerWaalsContact C-N 3.31Å; H746-R748 PolarHBondContact O-N 3.23Å; H746-K749 PolarHBondContact O-N 3.37Å; H746-K749 VanDerWaalsContact O-N 3.07Å; H746-K750 WeakPolarHBondContact O-CB 3.43Å; H746-K750 PolarHBondContact O-N 3.05Å
747	A	77.5	Confident	69.3	Low	48 Å²	48	99.3 Å²	99.3	40%	0.397	51%	0.507	S	S	.	.	H	α-helix	trans	-55.5	-43.5	176.5	0	0	0	0	0	112.6	Q743 K750 Q751	Q743-A747 PolarHBondContact O-N 2.69Å; A747-K750 PolarHBondContact O-N 2.96Å; A747-Q751 WeakPolarHBondContact O-CG 3.36Å; A747-Q751 PolarHBondContact O-N 3.47Å; A747-Q751 VanDerWaalsContact O-N 3.16Å
748	R	74.6	Confident	67.3	Low	192 Å²	192	100.2 Å²	100.2	73%	0.725	51%	0.513	S	S	*	.	H	α-helix	trans	-64.3	-44.4	173.3	-75.4	175.4	174.1	-173.5	-3.8	112.3	K744 I745 H746 K750 Q751 G752	K744-R748 WeakPolarHBondContact O-CB 3.25Å; K744-R748 WeakPolarHBondContact O-CG 3.34Å; K744-R748 PolarHBondContact O-N 2.87Å; I745-R748 PolarHBondContact O-N 3.34Å; H746-R748 VanDerWaalsContact C-N 3.31Å; H746-R748 PolarHBondContact O-N 3.23Å; R748-K750 VanDerWaalsContact C-N 3.31Å; R748-K750 PolarHBondContact O-N 3.01Å; R748-Q751 PolarHBondContact O-N 3.03Å; R748-G752 PolarHBondContact O-N 2.9Å
749	K	70.1	Confident	65.1	Low	158 Å²	158	107.2 Å²	107.2	69%	0.687	54%	0.535	S	S	*	.	H	α-helix	trans	-64.9	-35.3	178.8	-167	171	-176.8	177	0	112.2	I745 H746 Q751 G752 L753	I745-K749 WeakPolarHBondContact O-CB 3.24Å; I745-K749 PolarHBondContact O-N 3.48Å; H746-K749 PolarHBondContact O-N 3.37Å; H746-K749 VanDerWaalsContact O-N 3.07Å; K749-Q751 VanDerWaalsContact C-N 3.33Å; K749-G752 PolarHBondContact O-N 2.84Å; K749-L753 PolarHBondContact O-N 3.31Å; K749-L753 VanDerWaalsContact O-N 3.14Å
750	K	64.4	Low	63	Low	141 Å²	141	112.5 Å²	112.5	61%	0.613	57%	0.57	S	S	*	*	H	α-helix	trans	-66.9	-31.8	175	-143.2	167.2	-162.5	166.4	0	112.3	E728 H746 A747 R748	E728-K750 IonicContact OE1-NZ 3.25Å; E728-K750 PolarHBondContact OE1-NZ 2.89Å; H746-K750 WeakPolarHBondContact O-CB 3.43Å; H746-K750 PolarHBondContact O-N 3.05Å; A747-K750 PolarHBondContact O-N 2.96Å; R748-K750 VanDerWaalsContact C-N 3.31Å; R748-K750 PolarHBondContact O-N 3.01Å
751	Q	59.9	Low	60.5	Low	143 Å²	143	114.6 Å²	114.6	67%	0.668	59%	0.591	S	S	*	*	H	α-helix	trans	-77	-43.4	172	-71.6	171.3	-22.1	0	0	112	A747 R748 K749 L753 S754	A747-Q751 WeakPolarHBondContact O-CG 3.36Å; A747-Q751 PolarHBondContact O-N 3.47Å; A747-Q751 VanDerWaalsContact O-N 3.16Å; R748-Q751 PolarHBondContact O-N 3.03Å; K749-Q751 VanDerWaalsContact C-N 3.33Å; Q751-L753 VanDerWaalsContact C-N 3.3Å; Q751-L753 PolarHBondContact O-N 3.17Å; Q751-S754 VanDerWaalsContact O-CB 3.28Å; Q751-S754 WeakPolarHBondContact O-CB 3.4Å; Q751-S754 PolarHBondContact O-N 3.15Å
752	G	53.3	Low	58	Low	56 Å²	56	113.1 Å²	113.1	58%	0.577	59%	0.594	S	S	*	*	H	α-helix	trans	-59.8	-36.2	178.9	0	0	0	0	0	113.8	R748 K749 S754	R748-G752 PolarHBondContact O-N 2.9Å; K749-G752 PolarHBondContact O-N 2.84Å; G752-S754 PolarHBondContact O-N 3.33Å
753	L	48.9	Very low	55.6	Low	154 Å²	154	119.2 Å²	119.2	81%	0.806	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-5.2	177	-148.1	73.4	0	0	0	114	K749 Q751	K749-L753 PolarHBondContact O-N 3.31Å; K749-L753 VanDerWaalsContact O-N 3.14Å; Q751-L753 VanDerWaalsContact C-N 3.3Å; Q751-L753 PolarHBondContact O-N 3.17Å
754	S	46.4	Very low	53.1	Low	102 Å²	102	127.3 Å²	127.3	71%	0.713	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-8.2	-179.5	-167.5	0	0	0	0	114.1	Q751 G752	Q751-S754 VanDerWaalsContact O-CB 3.28Å; Q751-S754 WeakPolarHBondContact O-CB 3.4Å; Q751-S754 PolarHBondContact O-N 3.15Å; G752-S754 PolarHBondContact O-N 3.33Å
755	H	48.5	Very low	50.5	Low	170 Å²	170	129.8 Å²	129.8	79%	0.787	68%	0.677	S	S	*	*	S	Bend	trans	-104.5	18.9	-170.5	-152.8	-70.3	0	0	0	113.7
756	Y	40.6	Very low	48.1	Very low	193 Å²	193	137.4 Å²	137.4	76%	0.757	70%	0.699	S	S	*	*	S	Bend	trans	-137.8	50	-174.7	-130.4	-82.5	0	0	0	113.4
757	N	37.6	Very low	45.6	Very low	91 Å²	91	139.2 Å²	139.2	49%	0.487	73%	0.727	S	S	.	*	S	Bend	trans	-165.3	83.8	154.3	-103.8	-17.1	0	0	0	112.1	R1113	N757-R1113 PolarHBondContact ND2-O 3.03Å
758	S	35.8	Very low	43.6	Very low	97 Å²	97	149.4 Å²	149.4	68%	0.678	76%	0.755	S	S	*	*			trans	-168.5	124.1	146.7	-130.5	0	0	0	0	110.6
759	Y	35.6	Very low	41.4	Very low	185 Å²	185	143.8 Å²	143.8	73%	0.725	76%	0.757	S	S	*	*			trans	-106.8	-171	175.8	-66.8	-94.7	0	0	0	108.6
760	P	42.3	Very low	39.9	Very low	122 Å²	122	146 Å²	146	79%	0.792	77%	0.767	S	S	*	*			cis	-138.1	-161.7	0.9	43.2	-22.3	0	0	0	115.7
761	S	32.8	Very low	38.5	Very low	123 Å²	123	151.5 Å²	151.5	86%	0.86	78%	0.784	S	S	*	*			trans	-66	167	176.6	-44.9	0	0	0	0	115.2
762	G	30.6	Very low	37	Very low	59 Å²	59	148.5 Å²	148.5	61%	0.608	79%	0.791	S	S	*	*			cis	168.4	-162.7	-1.3	0	0	0	0	0	114.5
763	T	34.8	Very low	35.8	Very low	152 Å²	152	149.6 Å²	149.6	93%	0.933	80%	0.802	S	S	*	*			trans	75.7	151.2	-173.6	80.9	0	0	0	0	115.5
764	R	31.8	Very low	35.1	Very low	231 Å²	231	153.6 Å²	153.6	87%	0.872	81%	0.807	S	S	*	*			cis	-140.8	137.4	4.8	177.9	-176.6	-80.1	-172.9	-4.2	112.5
765	M	29.6	Very low	35	Very low	180 Å²	180	154.1 Å²	154.1	89%	0.887	81%	0.808	S	S	*	*			trans	5.7	131.7	160.7	-55.6	-60.1	-174.1	0	0	122.3
766	R	32.7	Very low	33.9	Very low	255 Å²	255	149.7 Å²	149.7	96%	0.962	80%	0.8	S	S	*	*				-146.3	136	121.2	-163.7	177.4	-65.6	-117.6	4.6	108.9
767	G	29.4	Very low	33.3	Very low	71 Å²	71	152.2 Å²	152.2	73%	0.732	81%	0.809	S	S	*	*			trans	-121.9	158.2	-165.6	0	0	0	0	0	116.5
768	R	35.4	Very low	32.7	Very low	262 Å²	262	150.4 Å²	150.4	99%	0.989	81%	0.812	S	S	*	*			trans	-132.9	155.1	149.5	-79.4	-172.4	173.2	-122.2	1	106.8
769	G	28.9	Very low	32.1	Very low	74 Å²	74	157.5 Å²	157.5	76%	0.763	82%	0.824	S	S	*	*			trans	-153.5	-178.5	-168.4	0	0	0	0	0	117.8
770	K	38	Very low	31.6	Very low	206 Å²	206	154 Å²	154	90%	0.896	83%	0.826	S	S	*	*			trans	62.2	88.4	167.1	-66.4	-170.2	175.8	-175.8	0	119.1
771	R	34.8	Very low	31.3	Very low	255 Å²	255	159.4 Å²	159.4	96%	0.962	83%	0.831	S	S	*	*				-168.9	149.2	113	-105.4	176	-86.7	-157.6	-2.2	108.5
772	G	29.7	Very low	32.1	Very low	80 Å²	80	158.4 Å²	158.4	83%	0.825	82%	0.822	S	S	*	*			cis	144.4	80.3	-5.3	0	0	0	0	0	111.8
773	G	27.8	Very low	31.9	Very low	79 Å²	79	160.9 Å²	160.9	81%	0.814	83%	0.83	S	S	*	*			trans	178.5	128.4	179.8	0	0	0	0	0	115.5
774	R	33.7	Very low	31.4	Very low	239 Å²	239	157 Å²	157	90%	0.902	82%	0.82	S	S	*	*			trans	-151.4	170.8	167.2	-99.3	-167.4	-169.9	-96.6	7.4	105.1
775	P	43.5	Very low	31.1	Very low	112 Å²	112	152.1 Å²	152.1	73%	0.727	82%	0.815	S	S	*	*			cis	-144.6	178.6	25.1	43.8	-25.4	0	0	0	117.7
776	A	27.3	Very low	30.9	Very low	77 Å²	77	148.5 Å²	148.5	64%	0.636	81%	0.808	S	S	*	*			trans	56.1	164.9	152.1	0	0	0	0	0	118.9
777	W	26.4	Very low	30.5	Very low	246 Å²	246	144.7 Å²	144.7	93%	0.932	80%	0.801	S	S	*	*			cis	-126.4	175.9	-1.2	-68.7	64.2	0	0	0	108.3
778	G	24.8	Very low	30.5	Very low	54 Å²	54	148.3 Å²	148.3	56%	0.557	80%	0.802	S	S	*	*			cis	151.5	121.6	-11.6	0	0	0	0	0	113.4
779	W	23.1	Very low	30	Very low	246 Å²	246	142.1 Å²	142.1	93%	0.932	79%	0.793	S	S	*	*			trans	67.4	163	166.2	-51.7	49	0	0	0	114.2
780	S	26	Very low	29.7	Very low	110 Å²	110	143.3 Å²	143.3	77%	0.769	80%	0.796	S	S	*	*			cis	-142.9	155.1	10	-60.3	0	0	0	0	114.1
781	R	35.4	Very low	29.1	Very low	236 Å²	236	139 Å²	139	89%	0.891	79%	0.792	S	S	*	*			trans	-129.7	173.3	147.1	-135.1	-170.6	169.5	-168.9	-3.7	104.7
782	P	50.7	Low	29.5	Very low	103 Å²	103	131.6 Å²	131.6	67%	0.669	78%	0.776	S	S	*	*			cis	-132.8	-156.7	-8.7	38.7	-17.1	0	0	0	112.1
783	S	25.8	Very low	29.3	Very low	111 Å²	111	135.2 Å²	135.2	78%	0.776	77%	0.772	S	S	*	*				146.9	158.4	126.4	-74.4	0	0	0	0	115.4
784	G	24.7	Very low	29.1	Very low	71 Å²	71	137.6 Å²	137.6	73%	0.732	77%	0.766	S	S	*	*			trans	96	86.7	-172.4	0	0	0	0	0	112.6
785	V	26.1	Very low	28.7	Very low	127 Å²	127	134.2 Å²	134.2	77%	0.77	77%	0.765	S	S	*	*			cis	86.2	140.7	20.4	-176	0	0	0	0	114.6
786	S	25.1	Very low	28	Very low	104 Å²	104	139.4 Å²	139.4	73%	0.727	77%	0.772	S	S	*	*			trans	72.7	106.8	-173.2	-56.4	0	0	0	0	114.8
787	E	24.5	Very low	28.4	Very low	175 Å²	175	141.3 Å²	141.3	82%	0.818	78%	0.777	S	S	*	*			cis	79.2	155.3	15.4	-148.2	-177.7	-131.1	0	0	116.5
788	I	28.4	Very low	28.4	Very low	147 Å²	147	135.2 Å²	135.2	75%	0.754	77%	0.767	S	S	*	*			trans	82.2	133.9	170.9	-54.6	174.5	0	0	0	116.4
789	V	24.6	Very low	28.9	Very low	132 Å²	132	138.1 Å²	138.1	80%	0.8	78%	0.779	S	S	*	*			cis	-161.4	148	-41.3	76.9	0	0	0	0	108.9
790	A	23.8	Very low	29.5	Very low	100 Å²	100	131.5 Å²	131.5	83%	0.826	77%	0.768	S	S	*	*			trans	-160.2	136.8	157.4	0	0	0	0	0	112.8
791	S	25.1	Very low	29.6	Very low	116 Å²	116	134.2 Å²	134.2	81%	0.811	77%	0.768	S	S	*	*			trans	-163	169.9	178.4	-121.5	0	0	0	0	107.6
792	P	42	Very low	29.2	Very low	98 Å²	98	133.2 Å²	133.2	64%	0.636	76%	0.764	S	S	*	*			cis	-140.5	-161.3	-8.1	40.4	-20.2	0	0	0	113.9
793	Q	25.8	Very low	28.5	Very low	157 Å²	157	135.5 Å²	135.5	73%	0.734	77%	0.771	S	S	*	*			trans	79.5	130.8	144.8	-80.2	178.3	33.4	0	0	123.4
794	N	23.9	Very low	28.6	Very low	129 Å²	129	134.4 Å²	134.4	69%	0.69	77%	0.768	S	S	*	*			trans	54.5	122.6	135.6	-51.7	-20.4	0	0	0	119
795	L	26.3	Very low	29	Very low	167 Å²	167	137 Å²	137	87%	0.874	77%	0.765	S	S	*	*				-157.8	144.1	56.8	-84.1	166.8	0	0	0	113.6
796	Y	27.6	Very low	28.9	Very low	222 Å²	222	138.5 Å²	138.5	87%	0.871	77%	0.768	S	S	*	*			trans	-86.8	175.6	152.2	-78.4	-88.6	0	0	0	109.2
797	P	35.8	Very low	29	Very low	116 Å²	116	141 Å²	141	75%	0.753	77%	0.768	S	S	*	*			cis	-117.3	-158	-2.2	22.2	4.5	0	0	0	109.9
798	V	27.2	Very low	29.3	Very low	118 Å²	118	143.2 Å²	143.2	72%	0.715	77%	0.769	S	S	*	*			cis	-149.6	138.2	25	177	0	0	0	0	110.7
799	S	34.5	Very low	29.2	Very low	116 Å²	116	145 Å²	145	81%	0.811	77%	0.774	S	S	*	*			trans	-108.3	144.3	156.4	-51.8	0	0	0	0	109.5
800	P	35.2	Very low	29.1	Very low	107 Å²	107	144 Å²	144	70%	0.695	77%	0.768	S	S	*	*				-137.7	164.8	129.7	21.5	-0.3	0	0	0	111
801	H	29.8	Very low	29.1	Very low	166 Å²	166	149.7 Å²	149.7	77%	0.769	77%	0.768	S	S	*	*			cis	-143.4	120.2	-14.9	-133.2	-81.5	0	0	0	104.9
802	R	26	Very low	29.2	Very low	216 Å²	216	151.8 Å²	151.8	82%	0.815	77%	0.765	S	S	*	*				67.1	107	64	-106.4	-73	174	153.3	-1.6	115.1
803	D	36.7	Very low	28.4	Very low	151 Å²	151	154.6 Å²	154.6	81%	0.807	77%	0.77	S	S	*	*			trans	-52.1	140.1	155.5	-52.6	-100.2	0	0	0	112.3
804	A	28.4	Very low	28.8	Very low	87 Å²	87	152.7 Å²	152.7	72%	0.719	77%	0.771	S	S	*	*			trans	-177.7	160.6	172.5	0	0	0	0	0	108.3
805	D	31.4	Very low	28.6	Very low	127 Å²	127	152.5 Å²	152.5	68%	0.679	77%	0.769	S	S	*	*			cis	-153.6	-150.4	-38.4	-142.4	-31.2	0	0	0	104.7
806	L	25.6	Very low	28.5	Very low	157 Å²	157	154.6 Å²	154.6	82%	0.822	77%	0.766	S	S	*	*			cis	-126.2	160	-0.4	-74.8	79.7	0	0	0	107.2
807	H	27.5	Very low	28.2	Very low	156 Å²	156	150 Å²	150	72%	0.722	76%	0.761	S	S	*	*			cis	75	58.3	17.9	-112.2	-77.7	0	0	0	118.8
808	R	30.3	Very low	27.6	Very low	223 Å²	223	155.4 Å²	155.4	84%	0.842	77%	0.766	S	S	*	*			trans	4.2	111.8	143.7	-178	-155.4	-170.9	-156.6	5.4	118.4
809	Q	25	Very low	27.4	Very low	183 Å²	183	155.2 Å²	155.2	86%	0.855	77%	0.765	S	S	*	*			trans	-146.4	146.2	146	-81.8	-174.1	-63.5	0	0	108.6
810	V	23.9	Very low	26.9	Very low	113 Å²	113	156.4 Å²	156.4	69%	0.685	76%	0.762	S	S	*	*			cis	109.9	100.5	20.6	171.4	0	0	0	0	113.6
811	R	22.6	Very low	26.3	Very low	219 Å²	219	155.7 Å²	155.7	83%	0.826	76%	0.76	S	S	*	*			trans	-153.7	145.6	144.8	-79.5	-163.2	174.4	-167.2	0.4	106.7
812	Q	27.2	Very low	26.1	Very low	159 Å²	159	156.3 Å²	156.3	74%	0.743	76%	0.763	S	S	*	*			cis	-148.4	169.6	-13.3	-111.2	167.2	-7.6	0	0	107.9
813	Q	26.7	Very low	26.1	Very low	157 Å²	157	151.3 Å²	151.3	73%	0.734	76%	0.757	S	S	*	*			trans	-89.2	174.7	171.3	-49	-177	-6.9	0	0	110.3
814	P	32.3	Very low	25.7	Very low	118 Å²	118	155 Å²	155	77%	0.766	76%	0.759	S	S	*	*				-125.6	169	63.2	42.8	-30.3	0	0	0	111.7
815	L	21.5	Very low	25.5	Very low	125 Å²	125	158.1 Å²	158.1	65%	0.654	76%	0.759	S	S	*	*				52.9	135.6	53.1	-99.9	73.4	0	0	0	113
816	R	22.6	Very low	25.3	Very low	211 Å²	211	158.7 Å²	158.7	80%	0.796	76%	0.761	S	S	*	*			cis	-161.6	176.8	-5.2	-149.6	176.8	-162.6	-159.7	5.6	107.7
817	T	22.3	Very low	25.2	Very low	126 Å²	126	156.9 Å²	156.9	77%	0.773	76%	0.757	S	S	*	*			trans	59.9	126.4	167.4	41.1	0	0	0	0	116.6
818	R	22.1	Very low	25	Very low	229 Å²	229	159 Å²	159	86%	0.864	77%	0.767	S	S	*	*			cis	78.7	128.2	30.8	-156.3	-150.5	168.1	165.3	-0.5	114.7
819	V	24.6	Very low	24.7	Very low	113 Å²	113	152 Å²	152	69%	0.685	76%	0.757	S	S	*	*			trans	98.6	132.9	166.7	-169.7	0	0	0	0	115
820	D	23.9	Very low	24.5	Very low	142 Å²	142	154.5 Å²	154.5	76%	0.759	76%	0.759	S	S	*	*			trans	-64.6	161.5	-180	-41.2	-110.5	0	0	0	113.1
821	S	22.8	Very low	25.1	Very low	91 Å²	91	154.5 Å²	154.5	64%	0.636	76%	0.761	S	S	*	*				167.3	121.9	106.1	-72.5	0	0	0	0	113.6
822	Q	25.6	Very low	25.2	Very low	180 Å²	180	147.9 Å²	147.9	84%	0.841	75%	0.748	S	S	*	*			trans	64.7	167.4	142	-66.8	163.4	-8.9	0	0	115.9
823	T	24.6	Very low	25	Very low	111 Å²	111	148.3 Å²	148.3	68%	0.681	75%	0.75	S	S	*	*			cis	-158.2	165.1	30.8	-37	0	0	0	0	111.4
824	R	28.6	Very low	25.5	Very low	228 Å²	228	144.8 Å²	144.8	86%	0.86	74%	0.741	S	S	*	*			trans	82.4	142.1	161.9	-61.7	-177.8	-179.6	170.5	0.5	118
825	H	25	Very low	25.2	Very low	153 Å²	153	147.5 Å²	147.5	71%	0.708	74%	0.743	S	S	*	*			cis	-169.9	157.1	-31	-134.6	-96.9	0	0	0	108.3
826	L	26.2	Very low	25.3	Very low	138 Å²	138	144.2 Å²	144.2	72%	0.723	73%	0.731	S	S	*	*			trans	53.9	107.9	164.2	-70.1	143.4	0	0	0	116.4
827	T	24	Very low	25.6	Very low	120 Å²	120	138.9 Å²	138.9	74%	0.736	71%	0.714	S	S	*	*				74.7	101.2	77.4	-60.9	0	0	0	0	113.1
828	E	23.4	Very low	25.7	Very low	200 Å²	200	138.2 Å²	138.2	94%	0.935	71%	0.71	S	S	*	*				-141.6	146.6	127.2	-122.7	171	-170.7	0	0	107.7
829	A	23.3	Very low	25.8	Very low	77 Å²	77	134 Å²	134	64%	0.636	71%	0.705	S	S	*	*			trans	-151.6	127.4	-162.5	0	0	0	0	0	113.2
830	W	22.4	Very low	25.8	Very low	235 Å²	235	136 Å²	136	89%	0.89	71%	0.706	S	S	*	*			trans	68.2	173.7	160.2	-75.4	62.1	0	0	0	113.2
831	P	35.6	Very low	25.6	Very low	112 Å²	112	140.2 Å²	140.2	73%	0.727	71%	0.712	S	S	*	*			cis	-137.2	166.3	15.3	42.4	-23.7	0	0	0	119.4
832	S	23.7	Very low	25.7	Very low	80 Å²	80	140.1 Å²	140.1	56%	0.559	71%	0.711	S	S	*	*			trans	37	132.4	136	-52.6	0	0	0	0	124.4
833	E	23.3	Very low	25.7	Very low	169 Å²	169	137.9 Å²	137.9	79%	0.79	71%	0.709	S	S	*	*			trans	67.3	168.2	134.2	-74.3	-158.1	106.9	0	0	120.2
834	P	38.4	Very low	25.7	Very low	83 Å²	83	138.7 Å²	138.7	54%	0.539	71%	0.71	S	S	.	*				-140.9	177.8	-51.4	42	-26.7	0	0	0	114.2
835	H	26	Very low	25.5	Very low	175 Å²	175	132.6 Å²	132.6	81%	0.81	70%	0.702	S	S	*	*			trans	64	160.7	158.7	-80.4	92.7	0	0	0	117.3
836	S	23.8	Very low	25.6	Very low	56 Å²	56	135.2 Å²	135.2	39%	0.392	71%	0.705	S	S	.	*			cis	-154.1	169.2	-12.7	61.5	0	0	0	0	112.3	N130	N130-S836 PolarHBondContact OD1-OG 3.02Å
837	Q	27.7	Very low	25.6	Very low	98 Å²	98	135.5 Å²	135.5	46%	0.458	70%	0.703	S	S	.	*			trans	65.3	111.3	158.9	-59.1	-165.5	22.5	0	0	122.9
838	T	24	Very low	25.7	Very low	112 Å²	112	134.1 Å²	134.1	69%	0.687	70%	0.704	S	S	*	*				49.8	126.1	116.6	-30.3	0	0	0	0	122.3
839	L	25.6	Very low	26.2	Very low	142 Å²	142	130.7 Å²	130.7	74%	0.743	70%	0.699	S	S	*	*			trans	143.2	150.2	132.9	-79	174.8	0	0	0	115.4
840	Q	23.2	Very low	26.4	Very low	155 Å²	155	131.3 Å²	131.3	72%	0.724	70%	0.704	S	S	*	*			trans	47.7	121.6	151.4	-75.8	166.3	-83.3	0	0	124.1
841	W	20.8	Very low	27.2	Very low	230 Å²	230	125.9 Å²	125.9	87%	0.871	70%	0.699	S	S	*	*				33.6	120.9	111.2	-72.7	67.6	0	0	0	120.6
842	S	25	Very low	26.7	Very low	89 Å²	89	125.8 Å²	125.8	62%	0.622	70%	0.701	S	S	*	*				55	153.9	115.4	-46.4	0	0	0	0	123.3
843	V	25.4	Very low	27	Very low	133 Å²	133	130.9 Å²	130.9	81%	0.806	72%	0.716	S	S	*	*			trans	74	135.3	146.6	156.3	0	0	0	0	116
844	D	25.1	Very low	28.4	Very low	128 Å²	128	128.2 Å²	128.2	68%	0.684	71%	0.713	S	S	*	*			cis	-163.6	178.3	-10.8	-143.1	-76.3	0	0	0	113.2
845	S	23.7	Very low	28.6	Very low	100 Å²	100	128.9 Å²	128.9	70%	0.699	72%	0.718	S	S	*	*			trans	60.4	133.3	140	-80.4	0	0	0	0	124.1
846	R	26.2	Very low	28.5	Very low	207 Å²	207	128.8 Å²	128.8	78%	0.781	72%	0.718	S	S	*	*				-150.1	127.1	120.7	-123.7	-176.1	-176.3	-105.9	-8.5	113.3
847	E	27.1	Very low	28.6	Very low	144 Å²	144	136.1 Å²	136.1	67%	0.673	74%	0.738	S	S	*	*			trans	55.9	125.4	149.5	-68.9	155.3	153.6	0	0	121.7
848	A	26.6	Very low	28.4	Very low	92 Å²	92	138.5 Å²	138.5	76%	0.76	75%	0.754	S	S	*	*			trans	-84.1	173.1	152.1	0	0	0	0	0	110.4
849	P	33.4	Very low	28.3	Very low	128 Å²	128	139.2 Å²	139.2	83%	0.831	76%	0.758	S	S	*	*				-143.4	161.9	87.6	38.6	-24	0	0	0	115.5
850	A	26.7	Very low	29	Very low	89 Å²	89	137.4 Å²	137.4	74%	0.736	76%	0.755	S	S	*	*			trans	-86.6	167.8	161.9	0	0	0	0	0	110.1
851	P	39.1	Very low	29	Very low	122 Å²	122	135.3 Å²	135.3	79%	0.792	75%	0.753	S	S	*	*				-133.7	-174.3	65.8	41.3	-25	0	0	0	111.9
852	S	26.3	Very low	29.1	Very low	110 Å²	110	132.8 Å²	132.8	77%	0.769	75%	0.751	S	S	*	*			cis	-145.4	169.4	15.6	-55.5	0	0	0	0	111.4
853	Q	30.4	Very low	30.1	Very low	187 Å²	187	132.7 Å²	132.7	87%	0.874	75%	0.749	S	S	*	*			trans	-98.7	-131.9	174.4	-71	-172	-22.3	0	0	113.8
854	P	51.8	Low	30.2	Very low	112 Å²	112	133.8 Å²	133.8	73%	0.727	74%	0.744	S	S	*	*				-117.6	-158.8	-118.3	42.2	-23.4	0	0	0	111.8
855	P	42.6	Very low	30.5	Very low	97 Å²	97	135.3 Å²	135.3	63%	0.63	75%	0.747	S	S	*	*			cis	-143.1	-166.2	1.4	44.1	-23.6	0	0	0	117
856	Q	24	Very low	30.6	Very low	173 Å²	173	138.1 Å²	138.1	81%	0.808	75%	0.749	S	S	*	*			trans	78.8	134.6	144.7	-82.7	163.4	-19.4	0	0	124
857	Y	25.4	Very low	30.6	Very low	211 Å²	211	139.1 Å²	139.1	83%	0.827	75%	0.753	S	S	*	*				22.7	159.6	129.8	-78.4	-98.8	0	0	0	124.4
858	D	23.3	Very low	30.7	Very low	147 Å²	147	137.7 Å²	137.7	79%	0.786	76%	0.759	S	S	*	*			trans	90.4	124.1	152.8	-64	-34.7	0	0	0	123.1
859	T	22.6	Very low	31.8	Very low	127 Å²	127	138.6 Å²	138.6	78%	0.779	76%	0.757	S	S	*	*			trans	-69.6	176.4	149.3	28.6	0	0	0	0	111.8
860	P	40.5	Very low	31.6	Very low	104 Å²	104	135.6 Å²	135.6	68%	0.675	75%	0.749	S	S	*	*			cis	-140.7	-162.2	6.7	26.2	1.4	0	0	0	115.3
861	T	22.7	Very low	31.7	Very low	112 Å²	112	142.9 Å²	142.9	69%	0.687	76%	0.758	S	S	*	*			trans	73.7	116.6	141.1	34.5	0	0	0	0	123.8
862	Q	24.3	Very low	31.5	Very low	176 Å²	176	141 Å²	141	82%	0.822	75%	0.753	S	S	*	*				77.2	179.6	125	-82.9	-163.8	-5.4	0	0	120.7
863	P	45.3	Very low	32	Very low	88 Å²	88	142 Å²	142	57%	0.571	75%	0.749	S	S	*	*				-140.7	-179.6	-59	42.7	-27.1	0	0	0	116
864	H	27.3	Very low	32.2	Very low	155 Å²	155	139.5 Å²	139.5	72%	0.718	74%	0.739	S	S	*	*			trans	65.1	155.8	162.6	-73.8	-85.5	0	0	0	117
865	H	30.6	Very low	32.3	Very low	161 Å²	161	139.5 Å²	139.5	75%	0.745	74%	0.74	S	S	*	*			cis	-159.1	168.7	-1.2	-127.9	-32.1	0	0	0	112
866	Q	27.5	Very low	31.8	Very low	158 Å²	158	140.7 Å²	140.7	74%	0.738	74%	0.74	S	S	*	*			trans	95.9	119.2	156.9	-55.3	-139.2	31	0	0	123
867	R	26.4	Very low	32	Very low	229 Å²	229	140.1 Å²	140.1	86%	0.864	74%	0.739	S	S	*	*			trans	66.4	127.2	138.7	-80.9	-179.7	167.7	166.1	-2.5	124.5
868	S	29.1	Very low	32.4	Very low	114 Å²	114	135 Å²	135	80%	0.797	73%	0.734	S	S	*	*			trans	-74.7	-174.1	165.9	-3.1	0	0	0	0	113.2
869	P	48.5	Very low	32.9	Very low	111 Å²	111	135.5 Å²	135.5	72%	0.721	74%	0.736	S	S	*	*			cis	-111	169.6	8.6	40.8	-30.5	0	0	0	113.7
870	G	29.8	Very low	33.2	Very low	65 Å²	65	132.7 Å²	132.7	67%	0.67	73%	0.732	S	S	*	*			cis	-161.5	-144.7	2.8	0	0	0	0	0	107.7
871	W	28.4	Very low	32.7	Very low	242 Å²	242	133.2 Å²	133.2	92%	0.917	74%	0.738	S	S	*	*			cis	176.9	158.9	-22	-91.3	-17.7	0	0	0	106.7
872	A	35.6	Very low	33.2	Very low	82 Å²	82	132.3 Å²	132.3	68%	0.678	74%	0.742	S	S	*	*			cis	-176.6	145.6	-25.4	0	0	0	0	0	108.3
873	D	37.2	Very low	34.2	Very low	131 Å²	131	130.5 Å²	130.5	70%	0.701	75%	0.746	S	S	*	*			cis	-168.1	175.1	-27.1	-136.9	-60.8	0	0	0	111.6
874	M	34.4	Very low	33.3	Very low	134 Å²	134	133.2 Å²	133.2	66%	0.66	76%	0.756	S	S	*	*			trans	73.1	148.5	154.6	-68.4	-76.6	90.7	0	0	121.3	L876	M874-L876 HydrophobicContact CE-CD1 3.9Å; M874-L876 HydrophobicContact SD-CD1 3.42Å; M874-L876 WeakPolarHBondContact SD-CD1 3.41Å
875	P	52.4	Low	33.2	Very low	113 Å²	113	132.6 Å²	132.6	73%	0.734	76%	0.757	S	S	*	*			cis	-123.2	-117	22.2	41.5	-25.4	0	0	0	117.6
876	L	32.6	Very low	32.8	Very low	122 Å²	122	131.5 Å²	131.5	64%	0.639	76%	0.756	S	S	*	*			trans	-141.7	162.3	-139.4	-105.8	68.4	0	0	0	112.6	M874	M874-L876 HydrophobicContact CE-CD1 3.9Å; M874-L876 HydrophobicContact SD-CD1 3.42Å; M874-L876 WeakPolarHBondContact SD-CD1 3.41Å
877	M	28.1	Very low	32.8	Very low	161 Å²	161	128.7 Å²	128.7	79%	0.793	75%	0.754	S	S	*	*			cis	-159.3	174.5	-10.4	-146.5	169.1	-173	0	0	111.1
878	S	34.2	Very low	32.8	Very low	102 Å²	102	125.7 Å²	125.7	71%	0.713	75%	0.75	S	S	*	*			trans	-142.9	-166.8	171.4	-66.8	0	0	0	0	108.8
879	L	34.5	Very low	32.8	Very low	158 Å²	158	127.9 Å²	127.9	83%	0.827	75%	0.749	S	S	*	*			cis	-169.2	145.5	16.8	-170.5	127.1	0	0	0	112.6
880	G	28.1	Very low	31.8	Very low	68 Å²	68	130.6 Å²	130.6	70%	0.701	75%	0.75	S	S	*	*			trans	82.7	175.3	149.6	0	0	0	0	0	119.1
881	S	30.1	Very low	31.6	Very low	115 Å²	115	133.3 Å²	133.3	80%	0.804	75%	0.749	S	S	*	*			cis	-162.3	172.9	-7.1	-86.6	0	0	0	0	111.3
882	A	32.2	Very low	31.7	Very low	94 Å²	94	127 Å²	127	78%	0.777	74%	0.742	S	S	*	*			trans	-90.5	177.6	-177.9	0	0	0	0	0	113.5
883	P	45.4	Very low	31.3	Very low	137 Å²	137	129.8 Å²	129.8	89%	0.89	75%	0.75	S	S	*	*				-141.4	-110.7	54	38.3	-14.3	0	0	0	117.4
884	N	26	Very low	30.8	Very low	146 Å²	146	129 Å²	129	78%	0.781	76%	0.755	S	S	*	*			trans	-142.2	155.5	-139.5	-169.7	23.9	0	0	0	116.6
885	L	26.2	Very low	30.6	Very low	142 Å²	142	127.8 Å²	127.8	74%	0.743	76%	0.76	S	S	*	*			trans	78.8	138	157.8	-147.5	73.6	0	0	0	122.1
886	D	22.5	Very low	29.3	Very low	137 Å²	137	128.6 Å²	128.6	73%	0.733	76%	0.763	S	S	*	*			trans	72.4	-178.7	156	-111.9	-61.5	0	0	0	123
887	S	27.3	Very low	29.2	Very low	100 Å²	100	130.4 Å²	130.4	70%	0.699	77%	0.772	S	S	*	*			trans	-131.9	156.6	-137.7	57.1	0	0	0	0	118.6
888	H	26.4	Very low	29.1	Very low	166 Å²	166	125.5 Å²	125.5	77%	0.769	76%	0.763	S	S	*	*			trans	-11.7	143	172.1	-81.6	-76.2	0	0	0	120
889	M	28.9	Very low	28.8	Very low	160 Å²	160	125.7 Å²	125.7	79%	0.788	76%	0.764	S	S	*	*			cis	-125.3	-125.1	21.6	-66.6	-74.8	176.2	0	0	113.7
890	K	27.8	Very low	28.5	Very low	168 Å²	168	126.2 Å²	126.2	73%	0.73	76%	0.762	S	S	*	*			cis	-161.3	165.3	3.5	-157.4	-170.3	169.8	-102.9	0	112.1
891	D	26.4	Very low	28.5	Very low	122 Å²	122	129 Å²	129	65%	0.652	77%	0.765	S	S	*	*			trans	74.4	154.3	161.8	-69.6	-28.1	0	0	0	121.1
892	S	29.2	Very low	29.2	Very low	110 Å²	110	127.8 Å²	127.8	77%	0.769	76%	0.755	S	S	*	*			trans	-171.7	155.6	-164.1	-59.9	0	0	0	0	112.6
893	T	28	Very low	28.9	Very low	139 Å²	139	131.7 Å²	131.7	85%	0.853	75%	0.754	S	S	*	*			trans	178.1	163.6	130.6	22.8	0	0	0	0	114.3
894	S	26.6	Very low	28	Very low	114 Å²	114	133.6 Å²	133.6	80%	0.797	75%	0.748	S	S	*	*			trans	74.9	145.5	175.7	77.3	0	0	0	0	117.6
895	S	28.8	Very low	27.9	Very low	109 Å²	109	132 Å²	132	76%	0.762	74%	0.744	S	S	*	*			cis	-179.2	132	-48.1	-95.1	0	0	0	0	106.2
896	V	25.9	Very low	27.6	Very low	131 Å²	131	130.5 Å²	130.5	79%	0.794	75%	0.745	S	S	*	*				173.7	148.9	86.4	158.4	0	0	0	0	105.6
897	L	30.1	Very low	28.7	Very low	160 Å²	160	129.7 Å²	129.7	84%	0.838	75%	0.747	S	S	*	*			cis	-161.4	164.7	-26.8	-94.5	179.9	0	0	0	104.9
898	G	26.9	Very low	28.4	Very low	58 Å²	58	130.4 Å²	130.4	60%	0.598	75%	0.753	S	S	*	*			cis	-179.6	-171.2	-2.9	0	0	0	0	0	111.3
899	S	28.5	Very low	28.5	Very low	106 Å²	106	126.3 Å²	126.3	74%	0.741	75%	0.748	S	S	*	*			trans	85	83	168.1	-55.3	0	0	0	0	120.7
900	H	27.3	Very low	28.3	Very low	168 Å²	168	125 Å²	125	78%	0.778	75%	0.748	S	S	*	*			trans	61.3	132	137.4	-47.5	-66.3	0	0	0	122.6
901	V	28.8	Very low	28.2	Very low	127 Å²	127	120.9 Å²	120.9	77%	0.77	74%	0.741	S	S	*	*			cis	93.2	137.5	24.3	170.2	0	0	0	0	113.4
902	P	44.6	Very low	28.4	Very low	90 Å²	90	122.3 Å²	122.3	58%	0.584	74%	0.743	S	S	*	*			cis	-152.3	-148.6	-26.4	43.6	-21.3	0	0	0	115
903	K	25.8	Very low	28.5	Very low	176 Å²	176	124.3 Å²	124.3	77%	0.765	74%	0.742	S	S	*	*			trans	80.9	150.9	159.6	-71.9	146.4	-171.8	173.7	0	117.5
904	K	26.1	Very low	28.7	Very low	176 Å²	176	123.2 Å²	123.2	77%	0.765	74%	0.736	S	S	*	*			cis	-163.4	155.8	-9.7	-124.3	179.3	178.6	-170.2	0	112.6
905	T	24.4	Very low	29.2	Very low	114 Å²	114	125.4 Å²	125.4	70%	0.699	73%	0.733	S	S	*	*			trans	34.8	127.8	149.9	52.1	0	0	0	0	123.6
906	S	20.5	Very low	29.5	Very low	110 Å²	110	127.6 Å²	127.6	77%	0.769	73%	0.731	S	S	*	*				23.2	156.5	118.3	-46.9	0	0	0	0	122
907	P	44.3	Very low	29.9	Very low	119 Å²	119	131 Å²	131	77%	0.773	73%	0.73	S	S	*	*			cis	-141.1	-171.3	-24.9	38.4	-18.9	0	0	0	114.7
908	S	22	Very low	30	Very low	116 Å²	116	130.9 Å²	130.9	81%	0.811	73%	0.725	S	S	*	*			trans	87	153.4	149.8	-150.2	0	0	0	0	121.2
909	A	26.9	Very low	30.2	Very low	80 Å²	80	135.3 Å²	135.3	66%	0.661	73%	0.73	S	S	*	*			trans	63.8	113.3	151.1	0	0	0	0	0	124
910	V	25.2	Very low	30.2	Very low	131 Å²	131	138.5 Å²	138.5	79%	0.794	73%	0.731	S	S	*	*				76.3	137.1	120.4	176.5	0	0	0	0	122.1
911	S	25.4	Very low	30	Very low	83 Å²	83	137.6 Å²	137.6	58%	0.58	73%	0.731	S	S	*	*			trans	68.1	113.7	156.5	-77	0	0	0	0	123.7
912	E	31.7	Very low	29.8	Very low	152 Å²	152	136.3 Å²	136.3	71%	0.71	73%	0.728	S	S	*	*				62.6	154.4	110.5	-67.5	173.6	104.3	0	0	124.3
913	M	30.6	Very low	28.8	Very low	151 Å²	151	137.1 Å²	137.1	74%	0.744	74%	0.735	S	S	*	*			trans	64.3	102.3	158.9	-69.9	171.3	-162.7	0	0	117.4
914	T	33	Very low	28.6	Very low	117 Å²	117	139.5 Å²	139.5	72%	0.718	74%	0.739	S	S	*	*				77.4	148.3	59.4	69.5	0	0	0	0	115.7
915	Q	37.8	Very low	28.5	Very low	160 Å²	160	137.7 Å²	137.7	75%	0.748	74%	0.738	S	S	*	*			trans	88.3	111.8	170.7	-60.3	-168.8	33.6	0	0	113.7
916	Q	33.8	Very low	28.4	Very low	154 Å²	154	137.6 Å²	137.6	72%	0.72	74%	0.742	S	S	*	*				99.5	150.7	65.8	-89	-173.2	19.5	0	0	110
917	R	35.6	Very low	28.5	Very low	203 Å²	203	138.6 Å²	138.6	77%	0.766	74%	0.744	S	S	*	*			cis	-176.8	-178.1	-6.4	179.9	176.6	-162.1	-165.8	5.7	107.9
918	Q	31.5	Very low	28.7	Very low	157 Å²	157	138.3 Å²	138.3	73%	0.734	74%	0.742	S	S	*	*			trans	121	144.7	153.3	-66	-178.4	25.3	0	0	113.5
919	H	31.8	Very low	28.8	Very low	151 Å²	151	139.1 Å²	139.1	70%	0.699	74%	0.742	S	S	*	*			cis	-160.6	168.4	-0.2	-123.2	-27.6	0	0	0	115.7
920	K	27.4	Very low	28.9	Very low	173 Å²	173	140.3 Å²	140.3	75%	0.752	75%	0.746	S	S	*	*			trans	66.5	177.6	152	-68.3	170.4	-175.3	178.8	0	119.5
921	L	23.8	Very low	28.9	Very low	150 Å²	150	140.7 Å²	140.7	79%	0.785	75%	0.748	S	S	*	*				-156.9	135.2	-98.8	-127.9	71.4	0	0	0	117.3
922	S	23.9	Very low	29	Very low	100 Å²	100	140.4 Å²	140.4	70%	0.699	75%	0.751	S	S	*	*			trans	49.6	126	134.3	64	0	0	0	0	125.5
923	S	22.7	Very low	29	Very low	107 Å²	107	141.7 Å²	141.7	75%	0.748	76%	0.759	S	S	*	*			trans	-166.4	160.8	140.7	-170.9	0	0	0	0	109.2
924	W	22.8	Very low	28.8	Very low	225 Å²	225	138.9 Å²	138.9	85%	0.852	76%	0.76	S	S	*	*			cis	129.2	151.7	-15.4	-90.2	55.2	0	0	0	117.6
925	N	23.4	Very low	28.8	Very low	138 Å²	138	139 Å²	139	74%	0.738	77%	0.766	S	S	*	*			trans	70	142.9	-177.8	-59.2	-13.8	0	0	0	116.1
926	S	22.5	Very low	28.3	Very low	112 Å²	112	137.4 Å²	137.4	78%	0.783	77%	0.767	S	S	*	*			cis	-151.3	170	1.6	-106	0	0	0	0	114.4
927	T	23.2	Very low	28.3	Very low	131 Å²	131	135 Å²	135	80%	0.804	77%	0.768	S	S	*	*			trans	-93.5	-164.9	-178.1	39.8	0	0	0	0	113.5
928	P	48.7	Very low	28.2	Very low	113 Å²	113	130 Å²	130	73%	0.734	76%	0.763	S	S	*	*			cis	-133.4	-177.6	-18.3	29.2	-7.4	0	0	0	114.8
929	T	23.8	Very low	28.2	Very low	134 Å²	134	129.2 Å²	129.2	82%	0.822	76%	0.763	S	S	*	*				-175	134.9	117.6	-73.6	0	0	0	0	113.8
930	S	28.4	Very low	28.1	Very low	104 Å²	104	129.5 Å²	129.5	73%	0.727	77%	0.765	S	S	*	*			trans	-36.7	167.8	170.6	-55.2	0	0	0	0	118.5
931	T	24.6	Very low	28.1	Very low	139 Å²	139	128.4 Å²	128.4	85%	0.853	76%	0.762	S	S	*	*			cis	-149.9	159.4	40.3	-59.5	0	0	0	0	114.5
932	A	27.9	Very low	28	Very low	77 Å²	77	128 Å²	128	64%	0.636	76%	0.761	S	S	*	*			trans	-150.7	-162.6	-174.9	0	0	0	0	0	112.1
933	M	31.1	Very low	27.9	Very low	180 Å²	180	132.4 Å²	132.4	89%	0.887	77%	0.768	S	S	*	*			trans	83.8	157	165.7	-53.6	-49.1	-167.4	0	0	118.1
934	A	27.6	Very low	28.6	Very low	91 Å²	91	133.1 Å²	133.1	75%	0.752	77%	0.77	S	S	*	*			cis	-171.5	178.8	-28.2	0	0	0	0	0	110.7
935	S	33.1	Very low	28.8	Very low	121 Å²	121	128.3 Å²	128.3	85%	0.846	77%	0.765	S	S	*	*			trans	-92.2	170.3	166.2	-45.9	0	0	0	0	112.6
936	T	26.6	Very low	30.3	Very low	125 Å²	125	127 Å²	127	77%	0.767	76%	0.764	S	S	*	*			trans	-127.3	125.6	170.8	51	0	0	0	0	109.2
937	S	33.4	Very low	31	Very low	105 Å²	105	127.7 Å²	127.7	73%	0.734	77%	0.766	S	S	*	*				76.7	152.5	59.8	88.4	0	0	0	0	112.6
938	S	33.7	Very low	31.1	Very low	96 Å²	96	126.3 Å²	126.3	67%	0.671	76%	0.762	S	S	*	*			cis	-154.1	170.6	17.7	-69	0	0	0	0	109
939	L	32.1	Very low	30.2	Very low	141 Å²	141	130.3 Å²	130.3	74%	0.738	76%	0.764	S	S	*	*			cis	-157.3	-141.3	-15.4	-101.2	167.6	0	0	0	105.6
940	Q	28.7	Very low	30.4	Very low	158 Å²	158	130.8 Å²	130.8	74%	0.738	76%	0.758	S	S	*	*			cis	-164.4	133.8	0.5	-149.9	162.1	-79.6	0	0	113.2
941	H	27.6	Very low	30.3	Very low	150 Å²	150	132.5 Å²	132.5	69%	0.694	76%	0.759	S	S	*	*			trans	40.5	133.3	147.9	-80.1	-88.4	0	0	0	128.3
942	D	22.2	Very low	30.5	Very low	142 Å²	142	128.8 Å²	128.8	76%	0.759	75%	0.749	S	S	*	*			trans	90.6	153.5	132.8	-61.3	-18.9	0	0	0	125.8
943	F	22.9	Very low	30.6	Very low	192 Å²	192	129.8 Å²	129.8	84%	0.842	76%	0.757	S	S	*	*			trans	-93	165.2	-169.9	-91.9	-83.3	0	0	0	112.4
944	P	36.6	Very low	30.4	Very low	122 Å²	122	125.3 Å²	125.3	79%	0.792	75%	0.748	S	S	*	*				-146.1	-149.3	52	42.7	-20	0	0	0	116.3
945	V	27.8	Very low	30.5	Very low	124 Å²	124	128.4 Å²	128.4	75%	0.752	75%	0.752	S	S	*	*			trans	-108.3	-166.7	-160.1	-136.5	0	0	0	0	112.7
946	P	54.2	Low	30.1	Very low	109 Å²	109	133.2 Å²	133.2	71%	0.708	75%	0.751	S	S	*	*			trans	-97.7	-171.5	-137.4	44.2	-31.6	0	0	0	114.4
947	P	36.3	Very low	30	Very low	128 Å²	128	131.9 Å²	131.9	83%	0.831	75%	0.747	S	S	*	*				-131.4	165.7	115.9	38.5	-32.4	0	0	0	115
948	S	26.4	Very low	29.6	Very low	102 Å²	102	132.3 Å²	132.3	71%	0.713	75%	0.745	S	S	*	*			trans	-99.9	-162.1	171.2	56.1	0	0	0	0	110.8
949	Y	29.9	Very low	29.5	Very low	197 Å²	197	138.9 Å²	138.9	77%	0.773	76%	0.755	S	S	*	*			trans	86.5	138.8	156.6	-138.2	-101.2	0	0	0	116.7
950	M	26.6	Very low	29.5	Very low	144 Å²	144	137.6 Å²	137.6	71%	0.709	76%	0.755	S	S	*	*			cis	-166.8	-173.5	-32.1	-115	-49.3	170.1	0	0	108.8
951	D	27.7	Very low	29.9	Very low	139 Å²	139	136.4 Å²	136.4	74%	0.743	76%	0.759	S	S	*	*			trans	74.2	144.8	158.8	-68.7	-49.4	0	0	0	119
952	G	28.8	Very low	30.4	Very low	62 Å²	62	135 Å²	135	64%	0.639	76%	0.764	S	S	*	*			cis	-177.2	178.8	-3.2	0	0	0	0	0	114.3
953	A	29.2	Very low	30.8	Very low	98 Å²	98	135.5 Å²	135.5	81%	0.81	77%	0.765	S	S	*	*			trans	38.7	112.3	168.8	0	0	0	0	0	118.6
954	A	27.6	Very low	31.4	Very low	85 Å²	85	133 Å²	133	70%	0.702	77%	0.765	S	S	*	*			cis	76	161.8	39	0	0	0	0	0	116
955	L	29.2	Very low	31.3	Very low	157 Å²	157	134.1 Å²	134.1	82%	0.822	77%	0.765	S	S	*	*			trans	77.1	138.3	-175	-50.7	179	0	0	0	116.9
956	W	25.2	Very low	31.8	Very low	221 Å²	221	132.5 Å²	132.5	84%	0.837	76%	0.759	S	S	*	*				-164.3	167.5	-62.1	-104.2	29.5	0	0	0	110.4
957	S	24.3	Very low	31	Very low	97 Å²	97	136 Å²	136	68%	0.678	77%	0.766	S	S	*	*			trans	77.3	113.6	154	-65	0	0	0	0	123.5
958	V	23.6	Very low	30.7	Very low	115 Å²	115	135.1 Å²	135.1	70%	0.697	76%	0.763	S	S	*	*				72.2	106.4	122.2	-177.6	0	0	0	0	121.2
959	R	33.4	Very low	31.1	Very low	234 Å²	234	135.3 Å²	135.3	88%	0.883	77%	0.765	S	S	*	*			trans	68.1	167.5	148.2	-67.8	173	-175.6	-178.9	0.6	117.7
960	P	31.2	Very low	32.1	Very low	114 Å²	114	131.2 Å²	131.2	74%	0.74	76%	0.762	S	S	*	*			cis	-123.3	-169.8	-3.6	42.7	-28.5	0	0	0	114.4
961	T	36.2	Very low	32.7	Very low	133 Å²	133	131.2 Å²	131.2	82%	0.816	77%	0.765	S	S	*	*			trans	-106.3	143.3	154.6	42.8	0	0	0	0	109.5
962	P	38.5	Very low	33	Very low	121 Å²	121	132.5 Å²	132.5	79%	0.786	76%	0.764	S	S	*	*				-150	-136.4	109.2	39.5	-19.5	0	0	0	114.9
963	L	31.3	Very low	33	Very low	152 Å²	152	136.3 Å²	136.3	80%	0.796	77%	0.769	S	S	*	*			trans	-127.3	170.9	-147.2	-102	71.7	0	0	0	117.1
964	T	34.9	Very low	33	Very low	138 Å²	138	135.2 Å²	135.2	85%	0.847	76%	0.755	S	S	*	*			trans	90.7	-179	145.3	39.1	0	0	0	0	123.2
965	N	33.9	Very low	33.1	Very low	147 Å²	147	139.4 Å²	139.4	79%	0.786	76%	0.76	S	S	*	*				-162.5	163	-127	179.3	34.6	0	0	0	115.4
966	S	39.2	Very low	33.1	Very low	90 Å²	90	138.2 Å²	138.2	63%	0.629	76%	0.755	S	S	*	*			trans	70.8	165.6	159.9	78.6	0	0	0	0	118.8
967	Q	37.3	Very low	33.4	Very low	182 Å²	182	134.8 Å²	134.8	85%	0.85	75%	0.752	S	S	*	*			cis	-118.8	-125.9	6.6	-56.5	179.9	1.8	0	0	113
968	S	29.8	Very low	34.1	Very low	109 Å²	109	138.7 Å²	138.7	76%	0.762	76%	0.76	S	S	*	*			cis	-156.3	-168.5	7.1	64.3	0	0	0	0	112.5
969	S	35.1	Very low	34.7	Very low	107 Å²	107	141 Å²	141	75%	0.748	77%	0.767	S	S	*	*			trans	-134	159.8	-167.9	-41.2	0	0	0	0	115.7
970	P	51	Low	34.9	Very low	110 Å²	110	134.5 Å²	134.5	71%	0.714	76%	0.755	S	S	*	*			trans	-82.2	171.1	145.8	37.6	-34.3	0	0	0	109.9
971	N	38.8	Very low	35.1	Very low	145 Å²	145	139 Å²	139	78%	0.775	76%	0.758	S	S	*	*			cis	-170.3	166.2	-11.4	-115.8	-43.7	0	0	0	104.8
972	K	34.9	Very low	35.3	Very low	165 Å²	165	142 Å²	142	72%	0.717	75%	0.754	S	S	*	*			cis	-166.9	153.5	-10.9	-160.1	-168	175.6	-171	0	103.7
973	L	28.4	Very low	35.4	Very low	142 Å²	142	141.6 Å²	141.6	74%	0.743	75%	0.752	S	S	*	*	S	Bend	cis	-117.2	165.1	6.8	-79.3	75.8	0	0	0	109.5
974	S	29.7	Very low	35.7	Very low	76 Å²	76	137.7 Å²	137.7	53%	0.531	75%	0.748	S	S	.	*			cis	-155.4	137.2	-13.6	-108.2	0	0	0	0	107.8
975	Q	30	Very low	35.8	Very low	173 Å²	173	134.9 Å²	134.9	81%	0.808	75%	0.747	S	S	*	*			trans	55.8	126	160.4	-63	170.5	-76.1	0	0	116
976	D	27.9	Very low	35.7	Very low	131 Å²	131	132.8 Å²	132.8	70%	0.701	75%	0.749	S	S	*	*			cis	-173.5	-161	31.2	-141.5	-71.8	0	0	0	110.6
977	L	32.3	Very low	35.5	Very low	150 Å²	150	137 Å²	137	79%	0.785	76%	0.759	S	S	*	*			trans	-75.2	126.1	-166.1	-68.4	155.2	0	0	0	117.8
978	Q	39.2	Very low	35.9	Very low	179 Å²	179	133.5 Å²	133.5	84%	0.836	75%	0.752	S	S	*	*			trans	-162.1	139.7	141	-101.6	150.9	68.3	0	0	108
979	L	36.7	Very low	35.9	Very low	163 Å²	163	134 Å²	134	85%	0.853	76%	0.755	S	S	*	*				71.5	152.9	58.5	-77.8	169.9	0	0	0	113.9
980	P	36.7	Very low	35.7	Very low	98 Å²	98	135.4 Å²	135.4	64%	0.636	76%	0.76	S	S	*	*	S	Bend	trans	-95.4	174.2	-159.8	38.7	-38.4	0	0	0	113.7
981	R	35.1	Very low	35.9	Very low	208 Å²	208	135.7 Å²	135.7	79%	0.785	76%	0.762	S	S	*	*			trans	65.7	-173.4	159.9	173.8	-175	156.6	-179.6	-2.8	111.7
982	W	40.4	Very low	36.6	Very low	195 Å²	195	133.7 Å²	133.7	74%	0.739	76%	0.757	S	S	*	*			trans	97.5	141.6	159.2	-72.6	90.5	0	0	0	117.1
983	P	41.5	Very low	36.7	Very low	114 Å²	114	135.1 Å²	135.1	74%	0.74	76%	0.763	S	S	*	*			trans	-115.8	-145.7	179.6	42.9	-25.3	0	0	0	108.5
984	G	38	Very low	36.8	Very low	70 Å²	70	136.7 Å²	136.7	72%	0.722	76%	0.764	S	S	*	*			trans	96.3	-166.7	134.4	0	0	0	0	0	116.9
985	G	36.5	Very low	36.8	Very low	79 Å²	79	140.8 Å²	140.8	81%	0.814	77%	0.774	S	S	*	*			trans	91.9	135.7	-152.2	0	0	0	0	0	110.6
986	A	32.3	Very low	36.7	Very low	102 Å²	102	139.8 Å²	139.8	84%	0.843	77%	0.77	S	S	*	*			cis	-156.4	175.1	-8.5	0	0	0	0	0	111.4
987	E	33.5	Very low	36.9	Very low	179 Å²	179	143 Å²	143	84%	0.836	77%	0.772	S	S	*	*			trans	-67.2	-176.4	160.4	-68.6	-163.7	102	0	0	112.4
988	P	45.8	Very low	36.6	Very low	108 Å²	108	141.5 Å²	141.5	70%	0.701	76%	0.764	S	S	*	*			cis	-129.6	-177	-13.2	14.2	11.2	0	0	0	113.9
989	S	29.8	Very low	36	Very low	119 Å²	119	143.1 Å²	143.1	83%	0.832	76%	0.763	S	S	*	*			trans	125.7	130.9	143	-51.3	0	0	0	0	116.7
990	T	31.1	Very low	35.4	Very low	138 Å²	138	141.3 Å²	141.3	85%	0.847	75%	0.754	S	S	*	*			trans	-102.9	172.7	176.7	34.9	0	0	0	0	111.8
991	P	54.8	Low	35	Very low	115 Å²	115	142.8 Å²	142.8	75%	0.747	76%	0.756	S	S	*	*			cis	-128.7	-159.5	-18.2	42.1	-25.5	0	0	0	111.2
992	P	54.7	Low	34.4	Very low	104 Å²	104	138.4 Å²	138.4	68%	0.675	76%	0.756	S	S	*	*			cis	-131.6	172.5	-14.3	40	-23.5	0	0	0	117
993	K	35.8	Very low	33.6	Very low	194 Å²	194	132.1 Å²	132.1	84%	0.843	75%	0.752	S	S	*	*			trans	94.3	125.1	158.6	-60.9	180	177.8	176.6	0	121.1
994	K	31.7	Very low	33.3	Very low	176 Å²	176	132.2 Å²	132.2	77%	0.765	75%	0.753	S	S	*	*			trans	63.6	142.2	159.5	-69.1	-177.8	162.6	-84.4	0	118.3
995	E	28.9	Very low	33.1	Very low	161 Å²	161	135 Å²	135	75%	0.752	76%	0.759	S	S	*	*			cis	-164.8	150.5	-19.7	-121.6	154.6	-175.8	0	0	107.3
996	E	28.1	Very low	33	Very low	153 Å²	153	137.7 Å²	137.7	72%	0.715	76%	0.759	S	S	*	*			trans	-133.6	133.7	-153	-118.9	-163.9	146.4	0	0	119.6
997	R	32.4	Very low	32.7	Very low	198 Å²	198	141.4 Å²	141.4	75%	0.747	76%	0.761	S	S	*	*				61.7	152.7	126.3	-100.7	165.4	135	-174.5	-1.5	127.6
998	L	26.2	Very low	32.3	Very low	119 Å²	119	137 Å²	137	62%	0.623	75%	0.749	S	S	*	*			trans	100.3	145.8	136.5	-112.8	62.6	0	0	0	123.2
999	W	25.2	Very low	31.4	Very low	212 Å²	212	136.6 Å²	136.6	80%	0.803	75%	0.749	S	S	*	*			trans	33.1	127.2	166.1	-59.8	108.7	0	0	0	120.5
1000	D	25	Very low	31.3	Very low	125 Å²	125	137.2 Å²	137.2	67%	0.668	75%	0.748	S	S	*	*				72	157.3	76	-157.7	15.3	0	0	0	115.9
1001	I	27.5	Very low	31.1	Very low	130 Å²	130	136.6 Å²	136.6	67%	0.667	74%	0.744	S	S	*	*			trans	70.7	103.6	164	-68.8	154.4	0	0	0	119.3
1002	S	23.3	Very low	29.8	Very low	115 Å²	115	137.3 Å²	137.3	80%	0.804	75%	0.746	S	S	*	*			trans	70.4	166.3	143.6	76.4	0	0	0	0	120.9
1003	G	24	Very low	28.6	Very low	63 Å²	63	140.4 Å²	140.4	65%	0.649	75%	0.752	S	S	*	*			trans	-87.9	-162.9	172.6	0	0	0	0	0	112.7
1004	P	35.8	Very low	29.1	Very low	117 Å²	117	136.1 Å²	136.1	76%	0.76	74%	0.744	S	S	*	*			cis	-125	-172.6	28.1	43.2	-31.6	0	0	0	114
1005	P	33.5	Very low	28.8	Very low	129 Å²	129	134.3 Å²	134.3	84%	0.838	74%	0.738	S	S	*	*			trans	-126.3	106.5	144	34.3	-23.1	0	0	0	112.3
1006	V	32.7	Very low	28.9	Very low	135 Å²	135	134.2 Å²	134.2	82%	0.818	74%	0.736	S	S	*	*			trans	-139.8	88.4	158.6	-179.2	0	0	0	0	108.2
1007	M	26.5	Very low	28.6	Very low	180 Å²	180	132.3 Å²	132.3	89%	0.887	73%	0.734	S	S	*	*			trans	-173.8	154.7	167.2	-88.1	-126.7	164.8	0	0	109.1
1008	S	24.7	Very low	28.2	Very low	85 Å²	85	133.8 Å²	133.8	59%	0.594	74%	0.74	S	S	*	*			cis	-165.1	143.8	-22	-100.3	0	0	0	0	111.5
1009	S	27.9	Very low	28.1	Very low	100 Å²	100	135.4 Å²	135.4	70%	0.699	75%	0.749	S	S	*	*			trans	35.2	113.2	137.2	-52.2	0	0	0	0	123.3
1010	T	28.1	Very low	28.2	Very low	132 Å²	132	128.7 Å²	128.7	81%	0.81	75%	0.746	S	S	*	*				77.5	164.9	121	-44.5	0	0	0	0	119.9
1011	V	26.6	Very low	28.1	Very low	125 Å²	125	128.8 Å²	128.8	76%	0.758	76%	0.755	S	S	*	*			trans	81.1	120.8	171.3	-176.8	0	0	0	0	114.4
1012	T	27.1	Very low	28	Very low	130 Å²	130	129.7 Å²	129.7	80%	0.798	76%	0.756	S	S	*	*			cis	-153.6	174.5	-4.3	9.9	0	0	0	0	111.7
1013	Q	29.6	Very low	29	Very low	169 Å²	169	129.7 Å²	129.7	79%	0.79	75%	0.753	S	S	*	*			trans	-58.5	169.2	158	-76.2	-102.4	15.1	0	0	112.1
1014	P	46.5	Very low	29.1	Very low	105 Å²	105	133.7 Å²	133.7	68%	0.682	76%	0.755	S	S	*	*			cis	-143	-176.8	18.7	46.3	-28	0	0	0	118.5
1015	E	26.2	Very low	28.7	Very low	138 Å²	138	137.3 Å²	137.3	65%	0.645	76%	0.759	S	S	*	*			trans	70.4	118.3	146.9	-78.6	-164.9	147	0	0	125.5
1016	K	29.4	Very low	29.2	Very low	159 Å²	159	135.3 Å²	135.3	69%	0.691	75%	0.746	S	S	*	*				70.2	127.3	124.3	-70.7	174.9	178.8	160.3	0	124.7
1017	T	23.7	Very low	28.8	Very low	113 Å²	113	140.6 Å²	140.6	69%	0.693	75%	0.752	S	S	*	*			trans	84.2	135.9	133.7	46.3	0	0	0	0	124.7
1018	W	22.9	Very low	28.7	Very low	229 Å²	229	136.3 Å²	136.3	87%	0.867	75%	0.745	S	S	*	*			trans	70.6	146.2	153.8	-68.9	-6.3	0	0	0	119.3
1019	N	25.1	Very low	28.9	Very low	153 Å²	153	138.7 Å²	138.7	82%	0.818	76%	0.762	S	S	*	*			cis	83.3	138.6	29.5	-77.8	-7.8	0	0	0	116.3
1020	G	25.6	Very low	28.8	Very low	70 Å²	70	137 Å²	137	72%	0.722	76%	0.76	S	S	*	*			trans	94.9	133.6	173.6	0	0	0	0	0	113.1
1021	C	22.7	Very low	28.7	Very low	128 Å²	128	139.2 Å²	139.2	87%	0.865	77%	0.766	S	S	*	*			cis	100.6	148.1	20.7	-69.2	0	0	0	0	115.7
1022	E	26.2	Very low	28.5	Very low	148 Å²	148	137 Å²	137	69%	0.692	76%	0.761	S	S	*	*			trans	70.1	162	170.5	-77.1	-149.8	99.7	0	0	118.3	Q1024	E1022-Q1024 WeakPolarHBondContact OE1-CG 3.37Å; E1022-Q1024 PolarHBondContact OE1-NE2 2.59Å
1023	P	44.8	Very low	28.4	Very low	115 Å²	115	137.6 Å²	137.6	75%	0.747	76%	0.764	S	S	*	*			cis	-121.1	151.7	2.1	15.8	8.5	0	0	0	117.7
1024	Q	24.9	Very low	28.5	Very low	148 Å²	148	133.8 Å²	133.8	69%	0.692	76%	0.761	S	S	*	*			trans	28.6	131.7	134.8	-47.8	-159.6	22.9	0	0	123.5	E1022	E1022-Q1024 WeakPolarHBondContact OE1-CG 3.37Å; E1022-Q1024 PolarHBondContact OE1-NE2 2.59Å
1025	K	29.1	Very low	28.4	Very low	192 Å²	192	134.2 Å²	134.2	84%	0.835	76%	0.764	S	S	*	*				31.9	160.5	115.9	-77.5	-178.9	177.8	177.5	0	120.7
1026	P	43.3	Very low	28.3	Very low	88 Å²	88	132 Å²	132	57%	0.571	77%	0.769	S	S	*	*			cis	-141.6	-178.2	23	27	-0.8	0	0	0	118
1027	W	23.7	Very low	28.1	Very low	245 Å²	245	129.9 Å²	129.9	93%	0.928	78%	0.775	S	S	*	*			trans	63.5	164.1	157.6	-70.3	-46.8	0	0	0	119.1
1028	A	25.8	Very low	28.4	Very low	91 Å²	91	129.1 Å²	129.1	75%	0.752	78%	0.779	S	S	*	*			cis	-162.3	173.7	-30.2	0	0	0	0	0	110.7
1029	S	28	Very low	28.6	Very low	135 Å²	135	126.4 Å²	126.4	94%	0.944	78%	0.777	S	S	*	*			trans	-92.6	153.4	-170.5	-45.6	0	0	0	0	116.1
1030	G	25.9	Very low	28.9	Very low	64 Å²	64	125.8 Å²	125.8	66%	0.66	77%	0.772	S	S	*	*			trans	158.3	124.4	166.3	0	0	0	0	0	110
1031	L	25.7	Very low	29	Very low	179 Å²	179	128 Å²	128	94%	0.937	77%	0.767	S	S	*	*				60.8	132	62.5	-62.1	174.6	0	0	0	113.2
1032	A	23.1	Very low	29.5	Very low	79 Å²	79	129.4 Å²	129.4	65%	0.653	76%	0.761	S	S	*	*			cis	-170.3	-166.6	-12.2	0	0	0	0	0	109.2
1033	V	24.9	Very low	29.7	Very low	141 Å²	141	126.8 Å²	126.8	86%	0.855	76%	0.759	S	S	*	*			trans	81.7	140.9	161.4	-171.4	0	0	0	0	117.6
1034	A	30.6	Very low	29	Very low	89 Å²	89	126.6 Å²	126.6	74%	0.736	76%	0.761	S	S	*	*			trans	-136.5	153.2	167.7	0	0	0	0	0	110.2
1035	P	44.2	Very low	29.1	Very low	114 Å²	114	124.3 Å²	124.3	74%	0.74	76%	0.761	S	S	*	*			trans	-126.3	155.8	146.5	15.8	6.8	0	0	0	110.3
1036	A	24	Very low	29.1	Very low	91 Å²	91	123.6 Å²	123.6	75%	0.752	76%	0.763	S	S	*	*			cis	68.4	134.4	46.1	0	0	0	0	0	113.1
1037	S	25.1	Very low	29	Very low	116 Å²	116	124.3 Å²	124.3	81%	0.811	77%	0.767	S	S	*	*			cis	-159.5	158.9	-7.6	-95.9	0	0	0	0	111.7
1038	A	29.8	Very low	29	Very low	96 Å²	96	119.7 Å²	119.7	79%	0.793	76%	0.759	S	S	*	*			trans	11.3	141.1	156.5	0	0	0	0	0	122.8
1039	Q	28.9	Very low	29	Very low	173 Å²	173	121 Å²	121	81%	0.808	76%	0.763	S	S	*	*			trans	-167	146.9	135.8	-112.5	-177.7	4.5	0	0	113.2
1040	I	30.3	Very low	29.3	Very low	139 Å²	139	118.9 Å²	118.9	71%	0.713	75%	0.753	S	S	*	*			trans	64	137.9	140.3	-72.7	167.1	0	0	0	119.8
1041	D	28.3	Very low	30.3	Very low	118 Å²	118	120.9 Å²	120.9	63%	0.631	76%	0.755	S	S	*	*			cis	-170.9	169.4	-17.7	-159.3	3.4	0	0	0	111.1
1042	Q	33.9	Very low	31.1	Very low	156 Å²	156	119 Å²	119	73%	0.729	75%	0.751	S	S	*	*			trans	56.8	148.1	156.2	-73.6	164.9	64.3	0	0	121.4
1043	S	30.2	Very low	31.6	Very low	93 Å²	93	120.8 Å²	120.8	65%	0.65	76%	0.759	S	S	*	*			cis	-169	158.3	-19.4	54.7	0	0	0	0	111.7
1044	S	29.1	Very low	31.7	Very low	112 Å²	112	123.9 Å²	123.9	78%	0.783	76%	0.764	S	S	*	*			trans	60.6	138.2	163.8	58.4	0	0	0	0	120.1
1045	S	27.9	Very low	31.6	Very low	100 Å²	100	123.3 Å²	123.3	70%	0.699	77%	0.766	S	S	*	*			cis	-160.7	119.4	-10	50.1	0	0	0	0	114.1
1046	M	27.5	Very low	31.2	Very low	176 Å²	176	125.2 Å²	125.2	87%	0.867	78%	0.775	S	S	*	*			trans	71.2	150.5	133.9	-60.5	-57.6	-178.5	0	0	121.3
1047	P	42.8	Very low	31.3	Very low	103 Å²	103	125.6 Å²	125.6	67%	0.669	78%	0.779	S	S	*	*			cis	-147.5	180	-31.6	38.2	-17.9	0	0	0	117.5
1048	I	23.9	Very low	31.7	Very low	148 Å²	148	124.8 Å²	124.8	76%	0.759	77%	0.765	S	S	*	*			trans	86.6	97.7	155.2	-44.2	-171	0	0	0	122
1049	S	24.3	Very low	31.8	Very low	118 Å²	118	125.9 Å²	125.9	83%	0.825	76%	0.757	S	S	*	*				45.6	151.6	117.6	-43.9	0	0	0	0	126.6
1050	A	34.3	Very low	31.7	Very low	91 Å²	91	124.1 Å²	124.1	75%	0.752	75%	0.753	S	S	*	*			trans	-110.3	-150.7	164.7	0	0	0	0	0	109.6
1051	P	47.8	Very low	31.5	Very low	107 Å²	107	129 Å²	129	70%	0.695	76%	0.763	S	S	*	*			cis	-139.6	-179	-14.9	40.6	-21.5	0	0	0	116.4
1052	T	43.2	Very low	31.5	Very low	140 Å²	140	128 Å²	128	86%	0.859	76%	0.757	S	S	*	*			trans	73	145.2	159.5	-22	0	0	0	0	118
1053	S	32	Very low	31.3	Very low	115 Å²	115	126.7 Å²	126.7	80%	0.804	75%	0.754	S	S	*	*			trans	-145.4	131.5	176.2	53.8	0	0	0	0	114.8
1054	H	28.7	Very low	31.2	Very low	207 Å²	207	130.1 Å²	130.1	96%	0.958	76%	0.759	S	S	*	*			trans	-163.7	116.8	159.5	-134	-42.3	0	0	0	106
1055	G	27.3	Very low	31.4	Very low	76 Å²	76	131 Å²	131	78%	0.784	76%	0.761	S	S	*	*			trans	141.6	137.9	178.3	0	0	0	0	0	113.6
1056	V	37	Very low	32.6	Very low	154 Å²	154	131.7 Å²	131.7	93%	0.933	76%	0.762	S	S	*	*			trans	-113.7	132.5	178.5	172.3	0	0	0	0	108.9
1057	A	25.2	Very low	33.8	Very low	100 Å²	100	129.3 Å²	129.3	83%	0.826	76%	0.76	S	S	*	*			trans	-158.7	142.5	154.3	0	0	0	0	0	108.3
1058	N	34.4	Very low	33.3	Very low	98 Å²	98	128.1 Å²	128.1	52%	0.524	77%	0.767	S	S	.	*			trans	-102.9	168.9	179.7	-155.7	-6.8	0	0	0	110.9	D184	D184-N1058 PolarHBondContact O-ND2 3.18Å
1059	N	30.3	Very low	33.4	Very low	119 Å²	119	125.7 Å²	125.7	64%	0.636	77%	0.769	S	S	*	*			trans	82.5	166.5	164.4	-47.4	-22.3	0	0	0	119
1060	L	28.5	Very low	34.2	Very low	136 Å²	136	126.3 Å²	126.3	71%	0.712	77%	0.77	S	S	*	*			trans	81.5	97.2	163.1	-90.2	57.3	0	0	0	119.9	D1062	L1060-D1062 WeakPolarHBondContact CD2-O 3.42Å
1061	W	25.2	Very low	34.1	Very low	243 Å²	243	130.7 Å²	130.7	92%	0.92	77%	0.772	S	S	*	*	S	Bend		-77	127.8	97.7	-70.6	63.9	0	0	0	106.4
1062	D	27.7	Very low	33.3	Very low	97 Å²	97	131.8 Å²	131.8	52%	0.519	78%	0.777	S	S	.	*	S	Bend	cis	-137.8	160.5	24.7	-125.7	-40.8	0	0	0	114	L1060	L1060-D1062 WeakPolarHBondContact CD2-O 3.42Å
1063	I	30.4	Very low	32.6	Very low	128 Å²	128	131.5 Å²	131.5	66%	0.656	78%	0.775	S	S	*	*			trans	75	109.1	152	-66.4	163.8	0	0	0	120.4
1064	Q	27.6	Very low	32.2	Very low	164 Å²	164	132.8 Å²	132.8	77%	0.766	77%	0.773	S	S	*	*			trans	81.8	95.1	137.4	-75	173.7	13	0	0	125.1
1065	T	33.6	Very low	32.1	Very low	132 Å²	132	127.9 Å²	127.9	81%	0.81	76%	0.762	S	S	*	*				75.5	159	121.8	44.7	0	0	0	0	123.2
1066	P	53.9	Low	32.2	Very low	113 Å²	113	129.9 Å²	129.9	73%	0.734	76%	0.758	S	S	*	*			trans	-108.1	-154.9	-162.5	47.3	-38.5	0	0	0	112.1
1067	P	52.8	Low	31.6	Very low	126 Å²	126	129.6 Å²	129.6	82%	0.818	75%	0.747	S	S	*	*			cis	-139.7	-174.6	-5.3	43.6	-25.4	0	0	0	116.6
1068	G	31.3	Very low	31.7	Very low	79 Å²	79	132.1 Å²	132.1	81%	0.814	74%	0.739	S	S	*	*			trans	132.6	154.4	143	0	0	0	0	0	119.2
1069	A	26.1	Very low	31.4	Very low	96 Å²	96	134.7 Å²	134.7	79%	0.793	75%	0.752	S	S	*	*			trans	-120	162.9	166	0	0	0	0	0	109.3
1070	P	41.7	Very low	31	Very low	131 Å²	131	135.1 Å²	135.1	85%	0.851	76%	0.759	S	S	*	*				-152.8	-117.1	98.2	39.2	-17.7	0	0	0	116
1071	K	32.1	Very low	31	Very low	183 Å²	183	134.8 Å²	134.8	80%	0.796	76%	0.758	S	S	*	*			trans	-138.7	158	-150	-58.5	174.5	-180	172.8	0	115.5
1072	T	30.2	Very low	31	Very low	131 Å²	131	129.2 Å²	129.2	80%	0.804	75%	0.746	S	S	*	*			trans	70	163.8	144.5	42.5	0	0	0	0	121.9
1073	V	28.5	Very low	31.2	Very low	133 Å²	133	131.2 Å²	131.2	81%	0.806	75%	0.752	S	S	*	*			trans	108.5	159.4	160.4	-171.5	0	0	0	0	116.3
1074	N	23.4	Very low	31.3	Very low	143 Å²	143	131.3 Å²	131.3	77%	0.765	75%	0.75	S	S	*	*			trans	-89.9	172	-158.1	-55.3	-53.1	0	0	0	115.9
1075	S	28.1	Very low	31.5	Very low	104 Å²	104	131.2 Å²	131.2	73%	0.727	75%	0.747	S	S	*	*			trans	83	122.1	135.1	-78.8	0	0	0	0	122
1076	V	27.4	Very low	31.7	Very low	118 Å²	118	130.2 Å²	130.2	72%	0.715	73%	0.733	S	S	*	*				67.8	138.2	120.9	180	0	0	0	0	119.2
1077	E	25.9	Very low	30.7	Very low	147 Å²	147	132.5 Å²	132.5	69%	0.687	73%	0.732	S	S	*	*			trans	68.8	163.7	161.3	-85.3	-177.2	159.6	0	0	117.1
1078	K	27.5	Very low	29.9	Very low	153 Å²	153	133.7 Å²	133.7	67%	0.665	73%	0.726	S	S	*	*			cis	-168.7	169.5	-30.3	-131.4	176.1	-159.6	160.5	0	107.6
1079	L	26.6	Very low	29.6	Very low	152 Å²	152	136.3 Å²	136.3	80%	0.796	73%	0.726	S	S	*	*			trans	61	165.3	177.1	-76.7	62.2	0	0	0	111.8
1080	V	23.6	Very low	29.6	Very low	129 Å²	129	136.9 Å²	136.9	78%	0.782	73%	0.725	S	S	*	*			cis	-131.7	141.4	12	171	0	0	0	0	105.6
1081	N	27.7	Very low	29.8	Very low	129 Å²	129	136.1 Å²	136.1	69%	0.69	72%	0.72	S	S	*	*			cis	74.8	81	21.4	-160.6	89.5	0	0	0	118
1082	N	24.8	Very low	29.5	Very low	125 Å²	125	132 Å²	132	67%	0.668	71%	0.714	S	S	*	*			trans	-161.7	136.9	135.8	-91.3	-7.2	0	0	0	106.9
1083	Q	32	Very low	29.2	Very low	139 Å²	139	136.9 Å²	136.9	65%	0.65	72%	0.718	S	S	*	*				63.4	130.8	75.4	-68.4	-170.3	-81.5	0	0	112.2
1084	E	32.4	Very low	29.1	Very low	131 Å²	131	135.4 Å²	135.4	61%	0.612	71%	0.713	S	S	*	*			cis	-162	160.8	9.4	-121.9	174.7	173.4	0	0	115.9
1085	F	32.4	Very low	29.1	Very low	161 Å²	161	133.3 Å²	133.3	71%	0.706	71%	0.71	S	S	*	*			trans	60.2	161	146.2	-84.3	-148.4	0	0	0	122.5
1086	Q	37.1	Very low	29	Very low	111 Å²	111	133.7 Å²	133.7	52%	0.519	71%	0.708	S	S	.	*			cis	-173.1	171.3	-31.4	-164.2	-170	68.7	0	0	110.2
1087	K	33.4	Very low	29	Very low	162 Å²	162	136.6 Å²	136.6	70%	0.704	71%	0.713	S	S	*	*			trans	100.1	146.5	152	-67.2	-178	180	172.5	0	119
1088	Q	35.3	Very low	29	Very low	151 Å²	151	135.4 Å²	135.4	71%	0.706	72%	0.716	S	S	*	*			cis	-171.9	176.7	-33.7	-131.6	-179.1	0.7	0	0	111.1
1089	V	24.5	Very low	29.5	Very low	133 Å²	133	133 Å²	133	81%	0.806	72%	0.717	S	S	*	*			trans	83.2	143	162.9	-156.7	0	0	0	0	118.9
1090	S	26.3	Very low	29.4	Very low	109 Å²	109	131 Å²	131	76%	0.762	71%	0.711	S	S	*	*			trans	-95.1	-147	-179.5	-34	0	0	0	0	110.7
1091	P	46.5	Very low	29.5	Very low	115 Å²	115	131.9 Å²	131.9	75%	0.747	71%	0.706	S	S	*	*			cis	-146.7	171.4	13.1	47	-27	0	0	0	120
1092	S	25.1	Very low	29.6	Very low	97 Å²	97	134.4 Å²	134.4	68%	0.678	71%	0.711	S	S	*	*			trans	74.6	148.2	139.8	-146.5	0	0	0	0	125.3
1093	W	24	Very low	29.8	Very low	233 Å²	233	134.9 Å²	134.9	88%	0.883	72%	0.718	S	S	*	*			trans	76.3	116.4	151.8	-83	-4.2	0	0	0	123.3
1094	S	26.8	Very low	30.2	Very low	101 Å²	101	133.3 Å²	133.3	71%	0.706	72%	0.72	S	S	*	*				50.9	140.1	111	-47.5	0	0	0	0	119.8
1095	S	24.1	Very low	30.1	Very low	99 Å²	99	134.6 Å²	134.6	69%	0.692	73%	0.729	S	S	*	*			cis	-157.9	144.6	21.6	-121.4	0	0	0	0	110.4
1096	V	26.3	Very low	29.8	Very low	113 Å²	113	131.4 Å²	131.4	69%	0.685	73%	0.727	S	S	*	*				61.6	125.7	94.9	178.7	0	0	0	0	112.7
1097	Q	26.9	Very low	29.2	Very low	178 Å²	178	132.8 Å²	132.8	83%	0.832	74%	0.737	S	S	*	*			cis	-156.4	164.6	25.8	-140.6	151.5	29.4	0	0	113.3
1098	T	24.8	Very low	28.7	Very low	123 Å²	123	132.9 Å²	132.9	76%	0.755	74%	0.74	S	S	*	*			trans	-91	-169.9	156.6	55.6	0	0	0	0	108.8
1099	P	39	Very low	28.2	Very low	103 Å²	103	135.6 Å²	135.6	67%	0.669	75%	0.745	S	S	*	*			cis	-148.4	-162.9	7.4	41	-16.7	0	0	0	117.3
1100	T	24.4	Very low	28.2	Very low	110 Å²	110	137.1 Å²	137.1	68%	0.675	74%	0.743	S	S	*	*			trans	72.8	116.6	147.1	47.4	0	0	0	0	124.7
1101	Q	26.8	Very low	29.6	Very low	146 Å²	146	134.9 Å²	134.9	68%	0.682	73%	0.726	S	S	*	*				79	151	123.6	-72.5	-170.6	5.3	0	0	124.9
1102	K	27.9	Very low	28.8	Very low	182 Å²	182	135 Å²	135	79%	0.791	72%	0.716	S	S	*	*			trans	83.5	95.9	148.3	-79.1	152.8	177.8	152.3	0	121.4
1103	V	30.3	Very low	29	Very low	136 Å²	136	137.9 Å²	137.9	82%	0.824	71%	0.713	S	S	*	*			trans	-67.8	143.7	144.9	174.4	0	0	0	0	108.5
1104	P	41	Very low	29.3	Very low	106 Å²	106	134.9 Å²	134.9	69%	0.688	71%	0.706	S	S	*	*				-159.5	173.3	71.5	42.5	-20.3	0	0	0	121.1
1105	I	28.6	Very low	29.3	Very low	157 Å²	157	134 Å²	134	81%	0.805	70%	0.699	S	S	*	*			trans	72.1	156.3	161.5	-76.8	164.6	0	0	0	115.6
1106	S	26.3	Very low	29.7	Very low	95 Å²	95	138.4 Å²	138.4	66%	0.664	71%	0.709	S	S	*	*			cis	-140.9	172.3	17.3	-149	0	0	0	0	111.5
1107	I	25.1	Very low	29.8	Very low	140 Å²	140	136.1 Å²	136.1	72%	0.718	71%	0.708	S	S	*	*			cis	81.5	125.2	15.7	-76.8	169.2	0	0	0	115.1
1108	Q	22.9	Very low	29.9	Very low	164 Å²	164	136.6 Å²	136.6	77%	0.766	72%	0.715	S	S	*	*			cis	-168.5	-176.1	-7.1	-154.1	-175.8	9.3	0	0	112.1
1109	Y	24	Very low	29.9	Very low	208 Å²	208	134.1 Å²	134.1	82%	0.816	71%	0.714	S	S	*	*			trans	99.3	161	158.3	-104.3	-88.8	0	0	0	122.9
1110	E	25.6	Very low	29.4	Very low	164 Å²	164	134 Å²	134	77%	0.766	71%	0.712	S	S	*	*			trans	-147.4	-159.2	-160.3	-138.5	-152.1	142	0	0	109
1111	P	54.3	Low	30.4	Very low	63 Å²	63	134.5 Å²	134.5	41%	0.409	72%	0.717	S	S	.	*				-125	-171.9	-65.8	29.7	-8.5	0	0	0	114.8
1112	H	30.4	Very low	30.3	Very low	116 Å²	116	132.7 Å²	132.7	54%	0.537	72%	0.715	S	S	.	*			trans	144.9	151.2	143.4	-79.6	-1.1	0	0	0	114.3
1113	R	30.2	Very low	30.1	Very low	159 Å²	159	136.4 Å²	136.4	60%	0.6	72%	0.724	S	S	*	*			cis	-167	161.1	-7.1	-110.8	-176.9	-163.6	-162.2	4.6	112.5	N757	N757-R1113 PolarHBondContact ND2-O 3.03Å
1114	F	29.4	Very low	29.7	Very low	170 Å²	170	133.5 Å²	133.5	75%	0.746	72%	0.715	S	S	*	*			trans	62.8	158.9	144	-84.2	-134.7	0	0	0	121.2
1115	S	26.1	Very low	29	Very low	81 Å²	81	138 Å²	138	57%	0.566	72%	0.724	S	S	*	*			cis	-172.1	152.9	-9.6	45.4	0	0	0	0	115.7
1116	Q	34.4	Very low	28.9	Very low	192 Å²	192	139.2 Å²	139.2	90%	0.897	73%	0.726	S	S	*	*			trans	59.6	161	150.2	-67.5	165.3	-11.9	0	0	120.7
1117	G	28.3	Very low	28.9	Very low	65 Å²	65	141.4 Å²	141.4	67%	0.67	73%	0.731	S	S	*	*			cis	168.2	156.1	-13.8	0	0	0	0	0	114.9
1118	I	28.8	Very low	29	Very low	189 Å²	189	141.2 Å²	141.2	97%	0.969	73%	0.731	S	S	*	*			trans	70.8	152.6	160.9	-56.2	166.8	0	0	0	116.5
1119	G	24.8	Very low	29.3	Very low	71 Å²	71	138 Å²	138	73%	0.732	73%	0.727	S	S	*	*			cis	-171.4	-176.1	-1.3	0	0	0	0	0	114.2
1120	T	27.7	Very low	29.5	Very low	101 Å²	101	135.6 Å²	135.6	62%	0.62	73%	0.733	S	S	*	*			trans	-108.5	158.4	-175.5	43.3	0	0	0	0	114
1121	P	45.7	Very low	29.7	Very low	120 Å²	120	130.9 Å²	130.9	78%	0.779	73%	0.728	S	S	*	*				-125.7	-175.4	85.3	-1.4	25.3	0	0	0	113.9
1122	V	23.9	Very low	29.7	Very low	108 Å²	108	133.8 Å²	133.8	66%	0.655	75%	0.748	S	S	*	*			cis	92.7	116.5	-6.4	-171.9	0	0	0	0	120.3
1123	W	24.7	Very low	29.6	Very low	259 Å²	259	136.7 Å²	136.7	98%	0.981	76%	0.761	S	S	*	*			trans	-172.8	177.5	141	-107.1	46.3	0	0	0	111.1
1124	A	22.5	Very low	29.5	Very low	76 Å²	76	134.7 Å²	134.7	63%	0.628	77%	0.767	S	S	*	*			trans	-151.8	-176.1	-156	0	0	0	0	0	117.8
1125	F	25.2	Very low	29.4	Very low	199 Å²	199	134.7 Å²	134.7	87%	0.873	77%	0.774	S	S	*	*			trans	75.4	162	177.2	-63.1	-80.3	0	0	0	115.9
1126	Q	26.2	Very low	29.4	Very low	184 Å²	184	138.4 Å²	138.4	86%	0.86	79%	0.786	S	S	*	*			cis	-141.5	-165.3	14.2	-146.1	158.6	39.1	0	0	112.8
1127	N	27.1	Very low	30	Very low	141 Å²	141	135.2 Å²	135.2	75%	0.754	78%	0.782	S	S	*	*			trans	-135.7	169.9	-156	-140.8	21.5	0	0	0	115.1
1128	N	27.6	Very low	29.8	Very low	135 Å²	135	135.3 Å²	135.3	72%	0.722	78%	0.784	S	S	*	*			trans	73.7	165.8	161.9	-66.7	8.9	0	0	0	119.4
1129	S	28.7	Very low	29.8	Very low	97 Å²	97	134.8 Å²	134.8	68%	0.678	78%	0.777	S	S	*	*				172.7	130.3	-54.9	55.3	0	0	0	0	111.6
1130	V	27.2	Very low	29.8	Very low	157 Å²	157	138 Å²	138	95%	0.952	78%	0.777	S	S	*	*			trans	-145.8	152.9	161.2	-178.3	0	0	0	0	109.6
1131	G	29.8	Very low	29.8	Very low	65 Å²	65	142 Å²	142	67%	0.67	79%	0.785	S	S	*	*			trans	-116.7	-141.6	-171.8	0	0	0	0	0	116.2
1132	P	55.5	Low	29.5	Very low	125 Å²	125	141.8 Å²	141.8	81%	0.812	78%	0.784	S	S	*	*			trans	-125.8	177.9	-136.3	42.2	-28.1	0	0	0	116.3
1133	Q	27.6	Very low	29.5	Very low	177 Å²	177	140.7 Å²	140.7	83%	0.827	79%	0.794	S	S	*	*			trans	-136.4	157.5	160	-92.2	-65.7	5.8	0	0	111.7
1134	T	29.5	Very low	29.4	Very low	117 Å²	117	132.2 Å²	132.2	72%	0.718	79%	0.787	S	S	*	*			trans	-116.4	165.3	-172.9	54	0	0	0	0	112.8
1135	L	26.1	Very low	29.5	Very low	170 Å²	170	132.1 Å²	132.1	89%	0.89	79%	0.794	S	S	*	*			trans	-170.8	170.4	136	-102.3	166.1	0	0	0	112.7
1136	L	27.1	Very low	29.7	Very low	158 Å²	158	130.4 Å²	130.4	83%	0.827	79%	0.789	S	S	*	*			trans	-133	-171	-170.2	-86.9	163.9	0	0	0	109.1
1137	P	45.5	Very low	29.8	Very low	125 Å²	125	128.5 Å²	128.5	81%	0.812	78%	0.78	S	S	*	*			cis	-135.2	-170.9	-14.7	24.4	1.1	0	0	0	114.8
1138	G	25.4	Very low	29.9	Very low	68 Å²	68	127.9 Å²	127.9	70%	0.701	78%	0.776	S	S	*	*			trans	137.9	114.6	158.8	0	0	0	0	0	113.9
1139	Q	28.6	Very low	29.9	Very low	178 Å²	178	128 Å²	128	83%	0.832	77%	0.772	S	S	*	*				66.7	131	62.2	-64.5	-149.5	33.6	0	0	114.5
1140	L	25	Very low	30	Very low	137 Å²	137	130.3 Å²	130.3	72%	0.717	77%	0.772	S	S	*	*			cis	-156.7	160.8	-4	-106.8	177.7	0	0	0	112.9
1141	K	28.1	Very low	30.1	Very low	185 Å²	185	131.5 Å²	131.5	80%	0.804	77%	0.767	S	S	*	*			trans	-15.4	179.3	148.5	-80.4	-177.7	177.2	-179.5	0	121.3
1142	P	38	Very low	30	Very low	117 Å²	117	136.8 Å²	136.8	76%	0.76	77%	0.774	S	S	*	*			cis	-145.2	175.3	-29.3	38.2	-19.4	0	0	0	117.2
1143	G	23.7	Very low	29.4	Very low	84 Å²	84	135.7 Å²	135.7	87%	0.866	77%	0.767	S	S	*	*			trans	83.6	163.7	149.9	0	0	0	0	0	118.2
1144	G	24	Very low	29.2	Very low	81 Å²	81	136.1 Å²	136.1	84%	0.835	77%	0.772	S	S	*	*			cis	167.7	149.2	-9.5	0	0	0	0	0	113.6
1145	G	24.7	Very low	29.1	Very low	74 Å²	74	134.4 Å²	134.4	76%	0.763	77%	0.769	S	S	*	*			trans	89.6	162	179	0	0	0	0	0	115.1
1146	Q	29.1	Very low	29.1	Very low	163 Å²	163	132.9 Å²	132.9	76%	0.762	77%	0.767	S	S	*	*			cis	-162.3	147	-4.7	-115.2	166.8	-73.5	0	0	110.1
1147	E	28.1	Very low	29	Very low	144 Å²	144	129 Å²	129	67%	0.673	76%	0.758	S	S	*	*			trans	61.2	160.3	145	-67.7	179.3	84.7	0	0	120.4
1148	L	27.8	Very low	28.2	Very low	129 Å²	129	126 Å²	126	68%	0.675	74%	0.744	S	S	*	*			cis	-156.2	166.1	-9	-123.9	179.3	0	0	0	112
1149	Q	29.6	Very low	28.4	Very low	136 Å²	136	129.3 Å²	129.3	64%	0.636	74%	0.741	S	S	*	*			trans	68.9	143.7	151.8	-140.8	79.4	26.4	0	0	122.4
1150	Q	29.7	Very low	28.4	Very low	146 Å²	146	127 Å²	127	68%	0.682	73%	0.733	S	S	*	*			trans	-33.7	162.4	170.2	-64.1	148.8	-10	0	0	117.8
1151	Q	29.3	Very low	28.6	Very low	183 Å²	183	126.5 Å²	126.5	86%	0.855	73%	0.73	S	S	*	*			cis	-159.4	-169.4	45.4	-144.2	158.3	63.5	0	0	115.1
1152	Q	26.7	Very low	28.7	Very low	175 Å²	175	122.9 Å²	122.9	82%	0.818	72%	0.718	S	S	*	*			trans	-86.6	-177.1	-172.5	-90.5	-174.9	11.7	0	0	114.3
1153	P	43.1	Very low	28.2	Very low	102 Å²	102	122.5 Å²	122.5	66%	0.662	71%	0.71	S	S	*	*			cis	-141.1	-170.6	-32.9	38.1	-19	0	0	0	114.9
1154	M	24.3	Very low	28.6	Very low	187 Å²	187	126.3 Å²	126.3	92%	0.921	71%	0.705	S	S	*	*			trans	77.2	164.7	149.1	-80.1	-69.5	173.6	0	0	121.9
1155	A	26.4	Very low	29.3	Very low	80 Å²	80	127.8 Å²	127.8	66%	0.661	70%	0.7	S	S	*	*			trans	-52.4	164.7	-167.3	0	0	0	0	0	116.8
1156	T	26.5	Very low	29.4	Very low	139 Å²	139	129 Å²	129	85%	0.853	70%	0.697	S	S	*	*				-168.1	175.8	52.2	-45.3	0	0	0	0	113.5
1157	A	25.8	Very low	30.1	Very low	77 Å²	77	127.2 Å²	127.2	64%	0.636	70%	0.699	S	S	*	*			trans	103.5	160.1	148.3	0	0	0	0	0	121.1	R674	R674-A1157 PolarHBondContact NH1-O 2.76Å; R674-A1157 PolarHBondContact NH2-O 3.14Å
1158	A	28	Very low	30	Very low	62 Å²	62	129.8 Å²	129.8	51%	0.512	71%	0.708	S	S	.	*			trans	-77.5	-159.1	-170.7	0	0	0	0	0	111.2	R674	R674-A1158 PolarHBondContact NH1-O 2.94Å
1159	Q	30.6	Very low	29.9	Very low	137 Å²	137	133.3 Å²	133.3	64%	0.64	72%	0.719	S	S	*	*			cis	-112.1	160.5	11.6	-107.5	73	-1	0	0	110.4
1160	I	28.6	Very low	30.1	Very low	129 Å²	129	131.5 Å²	131.5	66%	0.662	72%	0.721	S	S	*	*				55.8	104	76.2	-59.1	-178.5	0	0	0	110.2
1161	I	29	Very low	31.2	Very low	127 Å²	127	130.4 Å²	130.4	65%	0.651	73%	0.727	S	S	*	*				73.6	134.6	82.5	-77.2	166.7	0	0	0	111.5
1162	I	29.5	Very low	32.6	Very low	109 Å²	109	126.9 Å²	126.9	56%	0.559	72%	0.719	S	S	*	*			cis	-167.1	160.6	-16.5	-155	172.3	0	0	0	109.8
1163	N	26.8	Very low	32.6	Very low	109 Å²	109	127 Å²	127	58%	0.583	73%	0.725	S	S	*	*			trans	55.7	130.1	153.6	-73.2	-17.6	0	0	0	123.7
1164	Q	32.1	Very low	32	Very low	164 Å²	164	126.3 Å²	126.3	77%	0.766	73%	0.727	S	S	*	*			trans	71.2	170	136.2	-59.1	-81.9	26.4	0	0	117.6
1165	P	38.7	Very low	33.5	Very low	112 Å²	112	122.6 Å²	122.6	73%	0.727	72%	0.717	S	S	*	*			cis	-123	-178.8	-11.1	18.1	6.7	0	0	0	114.9
1166	S	28.6	Very low	33.7	Very low	100 Å²	100	126.3 Å²	126.3	70%	0.699	73%	0.725	S	S	*	*			trans	-64.4	174.4	158.1	53.7	0	0	0	0	113
1167	P	42.1	Very low	35.5	Very low	124 Å²	124	125.1 Å²	125.1	81%	0.805	72%	0.72	S	S	*	*			cis	-138.6	-168.7	20.6	41.4	-20.4	0	0	0	116.7
1168	F	27.3	Very low	37.3	Very low	199 Å²	199	126.4 Å²	126.4	87%	0.873	72%	0.722	S	S	*	*			trans	-118.7	148.4	-176.3	-120.9	-99.9	0	0	0	111.7
1169	F	24.7	Very low	37.4	Very low	203 Å²	203	131.8 Å²	131.8	89%	0.89	74%	0.741	S	S	*	*			trans	-118.3	168.6	158.1	-104.5	-91.7	0	0	0	109.1
1170	S	34.2	Very low	37.3	Very low	97 Å²	97	129.9 Å²	129.9	68%	0.678	75%	0.749	S	S	*	*			trans	-149.5	177.6	-174.9	-40.5	0	0	0	0	109.7
1171	P	52.8	Low	37.5	Very low	124 Å²	124	131.8 Å²	131.8	81%	0.805	76%	0.759	S	S	*	*			cis	-127.6	-112.1	0.2	25.5	2.7	0	0	0	115.6
1172	P	57.7	Low	38.2	Very low	108 Å²	108	132 Å²	132	70%	0.701	77%	0.769	S	S	*	*				-133.5	174.3	-128.6	42.5	-22.8	0	0	0	118.3
1173	L	27.7	Very low	38.1	Very low	178 Å²	178	129.9 Å²	129.9	93%	0.932	77%	0.774	S	S	*	*			trans	170	176.5	135.9	-91.1	162.2	0	0	0	113.1
1174	A	30.9	Very low	39.4	Very low	87 Å²	87	130.8 Å²	130.8	72%	0.719	79%	0.786	S	S	*	*			trans	-150.1	-167.3	-174	0	0	0	0	0	110
1175	P	55.8	Low	39.1	Very low	109 Å²	109	131.3 Å²	131.3	71%	0.708	79%	0.788	S	S	*	*			cis	-148.3	172.4	3.5	43.8	-23.3	0	0	0	120.5
1176	L	31.2	Very low	39.4	Very low	159 Å²	159	131 Å²	131	83%	0.832	79%	0.786	S	S	*	*			trans	69	172.3	152.1	-71.9	161.9	0	0	0	121
1177	P	62.8	Low	39.4	Very low	114 Å²	114	133.2 Å²	133.2	74%	0.74	79%	0.789	S	S	*	*			cis	-116.3	-79.4	-12.9	22.7	-5.8	0	0	0	125.5
1178	P	63.7	Low	38.7	Very low	103 Å²	103	135 Å²	135	67%	0.669	79%	0.786	S	S	*	*				-136.1	152.9	-123.5	39.3	-20.6	0	0	0	124.1
1179	L	31.3	Very low	38.8	Very low	175 Å²	175	130.1 Å²	130.1	92%	0.916	78%	0.777	S	S	*	*			trans	54.2	130	131.1	-58.5	172	0	0	0	127.8
1180	A	28.7	Very low	38.9	Very low	97 Å²	97	127.6 Å²	127.6	80%	0.802	78%	0.778	S	S	*	*				161.2	170.8	127.4	0	0	0	0	0	115.5
1181	L	30.9	Very low	38.6	Very low	169 Å²	169	127.1 Å²	127.1	89%	0.885	78%	0.78	S	S	*	*			trans	-149.4	-177.9	-170.7	-68.6	178.2	0	0	0	111.3
1182	P	44.4	Very low	37.4	Very low	132 Å²	132	128.5 Å²	128.5	86%	0.857	79%	0.786	S	S	*	*			cis	-142	-135.4	14	45.4	-22	0	0	0	116.4
1183	G	26.8	Very low	35.9	Very low	65 Å²	65	126.8 Å²	126.8	67%	0.67	79%	0.787	S	S	*	*			trans	-128.1	-159.4	174.9	0	0	0	0	0	113.3
1184	P	55.4	Low	35.8	Very low	127 Å²	127	123.1 Å²	123.1	83%	0.825	78%	0.783	S	S	*	*			cis	-136.9	-158	12	44.8	-24.5	0	0	0	116.5
1185	H	24.8	Very low	36	Very low	175 Å²	175	127.4 Å²	127.4	81%	0.81	79%	0.79	S	S	*	*			trans	-29.1	171.8	167.1	-76.8	-67.1	0	0	0	121.3
1186	P	45.7	Very low	35.5	Very low	105 Å²	105	127.5 Å²	127.5	68%	0.682	79%	0.79	S	S	*	*			cis	-144.8	-172.1	-19.6	35	-11.7	0	0	0	117.5
1187	L	27.6	Very low	35.3	Very low	147 Å²	147	131 Å²	131	77%	0.77	79%	0.792	S	S	*	*			trans	86.5	132.4	154.1	-61.3	-176.1	0	0	0	124.3
1188	H	28.3	Very low	34.9	Very low	162 Å²	162	130.2 Å²	130.2	75%	0.75	79%	0.788	S	S	*	*			trans	59.7	110.2	143.4	-82.7	-63.4	0	0	0	126.2
1189	S	29.3	Very low	34.2	Very low	97 Å²	97	130.8 Å²	130.8	68%	0.678	79%	0.791	S	S	*	*				83.6	151.8	118	-70	0	0	0	0	124.3
1190	V	27	Very low	34.1	Very low	150 Å²	150	129.7 Å²	129.7	91%	0.909	78%	0.781	S	S	*	*			trans	80.2	149.5	166.6	-161.1	0	0	0	0	116.4
1191	A	27.2	Very low	35.1	Very low	87 Å²	87	130.1 Å²	130.1	72%	0.719	78%	0.776	S	S	*	*			trans	-129.4	-161.7	-169.9	0	0	0	0	0	111.9
1192	V	27.5	Very low	35.2	Very low	153 Å²	153	127.6 Å²	127.6	93%	0.927	76%	0.763	S	S	*	*			trans	98.4	130.3	172.6	-176.6	0	0	0	0	115.3
1193	G	26.8	Very low	34.5	Very low	71 Å²	71	128.7 Å²	128.7	73%	0.732	76%	0.76	S	S	*	*			trans	157.1	78.3	160.1	0	0	0	0	0	119.4
1194	A	25.1	Very low	34.7	Very low	101 Å²	101	133 Å²	133	84%	0.835	76%	0.761	S	S	*	*			trans	46.7	96.1	144.3	0	0	0	0	0	122.1
1195	M	35.5	Very low	33.4	Very low	178 Å²	178	135.6 Å²	135.6	88%	0.877	76%	0.759	S	S	*	*			trans	-56.4	149	145.9	-76.6	-90.9	-72.4	0	0	113.2
1196	P	44.8	Very low	33.9	Very low	110 Å²	110	133 Å²	133	71%	0.714	76%	0.756	S	S	*	*				-148.5	170	113.9	38.2	-23.3	0	0	0	114.2
1197	R	27.7	Very low	33.7	Very low	232 Å²	232	133.7 Å²	133.7	88%	0.875	76%	0.761	S	S	*	*			cis	-161.2	167.2	-24.8	-106.4	-178	177.2	-176.1	-1.2	108.8
1198	P	54.7	Low	33.6	Very low	98 Å²	98	135.2 Å²	135.2	64%	0.636	76%	0.764	S	S	*	*			trans	-108.3	-161.4	-170.6	46.8	-37.9	0	0	0	112.3
1199	P	48.5	Very low	34.7	Very low	115 Å²	115	132.5 Å²	132.5	75%	0.747	76%	0.761	S	S	*	*				-144.7	145.9	59.7	36.9	-15.9	0	0	0	119
1200	H	29.6	Very low	34.6	Very low	152 Å²	152	134.1 Å²	134.1	70%	0.704	77%	0.766	S	S	*	*				30.3	160.6	121.8	-75.6	-66.8	0	0	0	123.3
1201	P	50.3	Low	34.6	Very low	106 Å²	106	134.7 Å²	134.7	69%	0.688	76%	0.761	S	S	*	*			cis	-148.9	153.2	33.5	41	-19.5	0	0	0	122
1202	N	31.5	Very low	34.7	Very low	117 Å²	117	135.9 Å²	135.9	63%	0.626	76%	0.759	S	S	*	*			trans	59.5	162.6	136.6	-56.7	-10.7	0	0	0	120.4
1203	I	29.7	Very low	34.7	Very low	155 Å²	155	136.7 Å²	136.7	80%	0.795	75%	0.753	S	S	*	*			cis	-135.3	149.3	23.1	-59.7	165.6	0	0	0	114
1204	F	31.5	Very low	34.9	Very low	156 Å²	156	144.1 Å²	144.1	68%	0.684	76%	0.759	S	S	*	*			trans	-48.9	173.5	169.2	-75.3	-97.4	0	0	0	116.7
1205	F	27.9	Very low	35.7	Very low	180 Å²	180	144.1 Å²	144.1	79%	0.789	75%	0.75	S	S	*	*			cis	-149.9	153.5	37.4	-90	-88.9	0	0	0	117.2
1206	T	36.5	Very low	35.4	Very low	120 Å²	120	144.5 Å²	144.5	74%	0.736	75%	0.749	S	S	*	*			trans	-128.3	164.4	142.5	56.5	0	0	0	0	108.2
1207	P	41.1	Very low	34.7	Very low	120 Å²	120	147 Å²	147	78%	0.779	75%	0.754	S	S	*	*				-141.7	172.9	123.8	37.6	-24.8	0	0	0	114.8
1208	Q	25.5	Very low	35.6	Very low	179 Å²	179	141.4 Å²	141.4	84%	0.836	75%	0.747	S	S	*	*			trans	-95.7	-132.1	173.8	-69.3	-176.9	-12.1	0	0	111.4
1209	P	51.8	Low	34.6	Very low	106 Å²	106	144.4 Å²	144.4	69%	0.688	75%	0.753	S	S	*	*				-119	-166.3	-103.1	36.3	-18.2	0	0	0	112.2
1210	V	26.8	Very low	33.6	Very low	130 Å²	130	145.4 Å²	145.4	79%	0.788	76%	0.757	S	S	*	*				177.4	166.4	126.2	148.6	0	0	0	0	110.5
1211	M	26.6	Very low	33.6	Very low	162 Å²	162	146 Å²	146	80%	0.798	76%	0.764	S	S	*	*			trans	-63.7	179	172.2	-53.7	-92.2	74.3	0	0	110.4
1212	T	28.8	Very low	33.2	Very low	113 Å²	113	146.7 Å²	146.7	69%	0.693	77%	0.769	S	S	*	*			cis	-174.4	-171.3	44.5	-34.6	0	0	0	0	108.2
1213	E	27.7	Very low	33.3	Very low	169 Å²	169	149.1 Å²	149.1	79%	0.79	78%	0.781	S	S	*	*			trans	73	122.5	162.3	-58.7	-50.3	82.5	0	0	121.4
1214	R	31.8	Very low	33.8	Very low	228 Å²	228	146.9 Å²	146.9	86%	0.86	78%	0.777	S	S	*	*			trans	-76.9	168.3	141.5	-88	177.1	169.3	165.1	-4.2	107.9
1215	P	41.2	Very low	33.6	Very low	100 Å²	100	147.7 Å²	147.7	65%	0.649	78%	0.783	S	S	*	*			cis	-150.3	-166.8	33.6	26.5	2.6	0	0	0	116.8
1216	H	29.5	Very low	33.6	Very low	186 Å²	186	145.8 Å²	145.8	86%	0.861	78%	0.78	S	S	*	*			trans	76.7	149.5	158.1	-65.3	-62.3	0	0	0	121.8
1217	M	31.1	Very low	33.9	Very low	164 Å²	164	145 Å²	145	81%	0.808	78%	0.777	S	S	*	*			trans	-117.4	155.5	165.8	-156.5	-160.9	-169.7	0	0	106.5
1218	P	45.3	Very low	34.2	Very low	113 Å²	113	144.2 Å²	144.2	73%	0.734	77%	0.772	S	S	*	*				-150.7	157.6	99.5	38.2	-21.4	0	0	0	117
1219	Q	33.3	Very low	34.4	Very low	161 Å²	161	143.6 Å²	143.6	75%	0.752	77%	0.769	S	S	*	*			trans	20.8	153.3	141.9	-52.2	-176.2	0.7	0	0	124.3
1220	T	28.6	Very low	33.3	Very low	137 Å²	137	144.7 Å²	144.7	84%	0.84	77%	0.774	S	S	*	*			trans	116.9	154.1	146.4	67.3	0	0	0	0	118.8
1221	L	30	Very low	33.5	Very low	163 Å²	163	147 Å²	147	85%	0.853	78%	0.776	S	S	*	*			trans	-101.9	-168.7	-174.5	-61.6	159.4	0	0	0	109.5
1222	P	41.2	Very low	33.6	Very low	121 Å²	121	142.3 Å²	142.3	79%	0.786	76%	0.763	S	S	*	*			cis	-125.1	-168.5	-20.4	20.8	4	0	0	0	112.3
1223	L	34.2	Very low	33.8	Very low	169 Å²	169	144.4 Å²	144.4	89%	0.885	76%	0.764	S	S	*	*			trans	-117.1	132.2	171.8	-124.3	173.3	0	0	0	110.7
1224	P	38.7	Very low	34.1	Very low	108 Å²	108	145.2 Å²	145.2	70%	0.701	77%	0.765	S	S	*	*			trans	-109.9	132.8	169.6	35.9	-28.3	0	0	0	114.4
1225	Q	28.5	Very low	34	Very low	173 Å²	173	143.3 Å²	143.3	81%	0.808	77%	0.771	S	S	*	*			trans	-12.8	157.5	132.9	-72.5	-176.7	-7.3	0	0	118
1226	L	28.6	Very low	33.3	Very low	140 Å²	140	141.6 Å²	141.6	73%	0.733	77%	0.772	S	S	*	*			cis	-148.2	-116.8	9.8	-118.1	164.8	0	0	0	114
1227	P	42.3	Very low	34	Very low	104 Å²	104	138.4 Å²	138.4	68%	0.675	77%	0.77	S	S	*	*				-134.2	-142.4	-124.5	42.3	-19	0	0	0	115.9
1228	P	47.6	Very low	34	Very low	103 Å²	103	142.9 Å²	142.9	67%	0.669	78%	0.778	S	S	*	*				-126.2	-164.4	-62.4	28.5	-6.1	0	0	0	114.1
1229	Q	28.4	Very low	34	Very low	165 Å²	165	144.2 Å²	144.2	77%	0.771	78%	0.779	S	S	*	*			trans	73.8	155	162.9	-54.8	-66.5	9.1	0	0	117.1
1230	T	29.4	Very low	34.5	Very low	129 Å²	129	142.3 Å²	142.3	79%	0.791	78%	0.78	S	S	*	*			cis	-148.2	167.5	2.8	-14.9	0	0	0	0	111.4
1231	E	30.3	Very low	34.9	Very low	180 Å²	180	144.5 Å²	144.5	84%	0.841	78%	0.778	S	S	*	*			trans	-83.5	-177.6	168.4	-106.8	-85.2	104.1	0	0	111.3
1232	A	29.2	Very low	35.4	Very low	62 Å²	62	142 Å²	142	51%	0.512	77%	0.772	S	S	.	*			cis	-158.1	-160.6	22.8	0	0	0	0	0	115
1233	H	32.3	Very low	35.7	Very low	158 Å²	158	142.1 Å²	142.1	73%	0.731	77%	0.773	S	S	*	*			trans	93.5	108.9	165.6	-62	-96	0	0	0	117.5
1234	K	34.7	Very low	36.5	Very low	185 Å²	185	140.5 Å²	140.5	80%	0.804	76%	0.76	S	S	*	*				72.1	102.3	78.8	-80.6	-173.9	176	174.5	0	116
1235	L	30	Very low	37.3	Very low	188 Å²	188	146.6 Å²	146.6	98%	0.984	77%	0.769	S	S	*	*				168	168	128.1	-90.8	162.9	0	0	0	110.7
1236	G	26.4	Very low	38.7	Very low	64 Å²	64	142.9 Å²	142.9	66%	0.66	76%	0.755	S	S	*	*			trans	-124.1	170.3	-164.5	0	0	0	0	0	117.6
1237	S	43.8	Very low	40.5	Very low	119 Å²	119	139.6 Å²	139.6	83%	0.832	74%	0.738	S	S	*	*			trans	53.8	95.9	157	54.5	0	0	0	0	120.4
1238	R	31.6	Very low	42	Very low	258 Å²	258	140.5 Å²	140.5	97%	0.974	73%	0.733	S	S	*	*				-159.3	148.1	129.4	-109.1	164.5	-165.9	-128	2.9	113.2
1239	L	45.4	Very low	43.6	Very low	142 Å²	142	135.7 Å²	135.7	74%	0.743	70%	0.701	S	S	*	*			trans	-79.1	163.6	173.8	-86.5	167.1	0	0	0	110.5	F1241	L1239-F1241 HydrophobicContact CD2-CD2 4.08Å; L1239-F1241 HydrophobicContact CD2-CE2 4.4Å
1240	P	43.3	Very low	45.8	Very low	121 Å²	121	136 Å²	136	79%	0.786	71%	0.705	S	S	*	*			cis	-144.5	169.7	41.6	41.8	-22.3	0	0	0	119.3
1241	F	37.3	Very low	47.9	Very low	182 Å²	182	135.2 Å²	135.2	80%	0.798	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-83.8	152.2	162.8	-76.1	-94.4	0	0	0	111.4	L1239	L1239-F1241 HydrophobicContact CD2-CD2 4.08Å; L1239-F1241 HydrophobicContact CD2-CE2 4.4Å
1242	P	40.3	Very low	50.4	Low	112 Å²	112	128.9 Å²	128.9	73%	0.727	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-72.3	155.7	173.8	31.3	-35.4	0	0	0	112.4
1243	P	46.3	Very low	52.5	Low	123 Å²	123	127.8 Å²	127.8	80%	0.799	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-76.6	137.4	-168.7	29.4	-35.6	0	0	0	114.5	R1245	P1243-R1245 PolarHBondContact O-N 3.42Å
1244	E	52.6	Low	54.7	Low	134 Å²	134	124.8 Å²	124.8	63%	0.626	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-62.7	128.7	167.4	-64.5	-176.7	137.8	0	0	110.4	L1246	E1244-L1246 PolarHBondContact O-N 2.8Å; E1244-L1246 VanDerWaalsContact O-N 3.12Å
1245	R	54.9	Low	56.6	Low	236 Å²	236	118.9 Å²	118.9	89%	0.891	64%	0.636	S	S	*	*			trans	-74.1	101.8	171.6	-82.2	-175.8	169.9	172.5	-2.9	109.8	P1243 L1247	P1243-R1245 PolarHBondContact O-N 3.42Å; R1245-L1247 PolarHBondContact O-N 3.02Å
1246	L	57.8	Low	59	Low	96 Å²	96	111.8 Å²	111.8	50%	0.503	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-57.9	133.7	174	-54	178.3	0	0	0	110.8	E1244 P1257	E1244-L1246 PolarHBondContact O-N 2.8Å; E1244-L1246 VanDerWaalsContact O-N 3.12Å; L1246-P1257 HydrophobicContact CD2-CB 3.81Å
1247	L	67.4	Low	60.8	Low	71 Å²	71	111.5 Å²	111.5	37%	0.372	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.3	120.9	178.6	-61.6	170.9	0	0	0	109.2	R1245 L1256 E1259 L1262	R1245-L1247 PolarHBondContact O-N 3.02Å; L1247-L1256 PolarHBondContact N-O 2.92Å; L1247-L1256 PolarHBondContact O-N 3.13Å; L1247-E1259 HydrophobicContact CD1-CB 3.76Å; L1247-E1259 HydrophobicContact CD1-CG 4.25Å; L1247-L1262 HydrophobicContact CB-CD2 3.65Å
1248	Q	73.6	Confident	62.4	Low	122 Å²	122	113.5 Å²	113.5	57%	0.57	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.6	136.7	-170.5	-156.4	163.6	9	0	0	112.6	M1250 G1253	Q1248-M1250 PolarHBondContact O-N 3.34Å; Q1248-G1253 VanDerWaalsContact CG-O 3.3Å; Q1248-G1253 WeakPolarHBondContact CG-O 3.44Å; Q1248-G1253 PolarHBondContact NE2-O 2.82Å
1249	C	80.7	Confident	64.6	Low	2 Å²	2	106.9 Å²	106.9	1%	0.014	56%	0.555	C	S	.	*	P	Polyproline II helix	trans	-76.6	116.7	177.1	-174	0	0	0	0	111.1	I1251 C1252 G1253 L1254 L1262 Y1266	C1249-I1251 PolarHBondContact O-N 3.18Å; C1249-I1251 VanDerWaalsContact O-N 3.15Å; C1249-C1252 VanDerWaalsContact CB-SG 3.58Å; C1249-C1252 PolarHBondContact O-N 3.22Å; C1249-G1253 WeakPolarHBondContact O-CA 3.22Å; C1249-G1253 PolarHBondContact O-N 2.87Å; C1249-L1254 WeakPolarHBondContact CB-O 3.41Å; C1249-L1254 PolarHBondContact N-O 3.05Å; C1249-L1262 HydrophobicContact CB-CD1 3.55Å; C1249-Y1266 HydrophobicContact CB-CE1 4.45Å; C1249-Y1266 WeakPolarHBondContact SG-CE1 3.3Å
1250	M	74.8	Confident	66.2	Low	171 Å²	171	105.9 Å²	105.9	84%	0.842	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.2	-177.6	-62.8	-70.8	-73.5	0	0	114	Q1248 Y1266	Q1248-M1250 PolarHBondContact O-N 3.34Å; M1250-Y1266 HydrophobicContact CB-CE1 4.48Å; M1250-Y1266 WeakPolarHBondContact CG-OH 3.44Å; M1250-Y1266 PolarHBondContact N-OH 3.43Å
1251	I	72.6	Confident	68	Low	113 Å²	113	103.7 Å²	103.7	58%	0.579	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-35.5	-179.8	-62.4	178.7	0	0	0	112	C1249 Y1266 H1269	C1249-I1251 PolarHBondContact O-N 3.18Å; C1249-I1251 VanDerWaalsContact O-N 3.15Å; I1251-Y1266 HydrophobicContact CD1-CD1 3.86Å; I1251-Y1266 HydrophobicContact CD1-CE1 4.2Å; I1251-Y1266 HydrophobicContact CG1-CD1 4.22Å; I1251-Y1266 HydrophobicContact CG1-CE1 4.06Å; I1251-H1269 HydrophobicContact CD1-CB 3.93Å; I1251-H1269 HydrophobicContact CG2-CB 4.19Å
1252	C	84.1	Confident	70.2	Confident	48 Å²	48	95.9 Å²	95.9	32%	0.324	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.4	-1.1	-171.8	65.8	0	0	0	0	115.3	C1249 L1254 H1265 H1269	C1249-C1252 VanDerWaalsContact CB-SG 3.58Å; C1249-C1252 PolarHBondContact O-N 3.22Å; C1252-L1254 PolarHBondContact O-N 3.15Å; C1252-H1265 PolarHBondContact SG-NE2 3.16Å; C1252-H1269 WeakPolarHBondContact CB-CE1 3.14Å; C1252-H1269 VanDerWaalsContact CB-NE2 3.32Å; C1252-H1269 WeakPolarHBondContact CB-NE2 3.17Å; C1252-H1269 PolarHBondContact SG-NE2 3.4Å
1253	G	73.3	Confident	72.1	Confident	39 Å²	39	94.5 Å²	94.5	40%	0.402	48%	0.481	S	S	.	.			trans	73.3	2	-178.1	0	0	0	0	0	115.7	Q1248 C1249 S1255	Q1248-G1253 VanDerWaalsContact CG-O 3.3Å; Q1248-G1253 WeakPolarHBondContact CG-O 3.44Å; Q1248-G1253 PolarHBondContact NE2-O 2.82Å; C1249-G1253 WeakPolarHBondContact O-CA 3.22Å; C1249-G1253 PolarHBondContact O-N 2.87Å; G1253-S1255 PolarHBondContact O-N 3.43Å
1254	L	77.9	Confident	73.8	Confident	95 Å²	95	93.3 Å²	93.3	50%	0.497	47%	0.466	S	S	.	.			trans	-70.8	122.2	179.7	-79.8	165.6	0	0	0	111.9	C1249 C1252 H1265	C1249-L1254 WeakPolarHBondContact CB-O 3.41Å; C1249-L1254 PolarHBondContact N-O 3.05Å; C1252-L1254 PolarHBondContact O-N 3.15Å; L1254-H1265 WeakPolarHBondContact CD1-NE2 3.17Å
1255	S	73.8	Confident	75.4	Confident	61 Å²	61	88.3 Å²	88.3	43%	0.427	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	121.3	175.9	46.4	0	0	0	0	110.8	G1253	G1253-S1255 PolarHBondContact O-N 3.43Å
1256	L	82.2	Confident	76.8	Confident	39 Å²	39	80.7 Å²	80.7	20%	0.204	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	136.2	-173	-69	165.8	0	0	0	110.1	L1247 R1258 L1262 H1265	L1247-L1256 PolarHBondContact N-O 2.92Å; L1247-L1256 PolarHBondContact O-N 3.13Å; L1256-R1258 VanDerWaalsContact C-N 3.25Å; L1256-R1258 PolarHBondContact O-N 3.34Å; L1256-L1262 HydrophobicContact CB-CB 4.37Å; L1256-L1262 HydrophobicContact CD1-CB 4.18Å; L1256-L1262 HydrophobicContact CD1-CD1 4.17Å; L1256-H1265 HydrophobicContact CD1-CB 3.73Å
1257	P	63.8	Low	77.9	Confident	58 Å²	58	80.4 Å²	80.4	38%	0.377	41%	0.413	S	S	.	.	S	Bend	trans	-73.2	-14.8	-171.5	29.1	-35.7	0	0	0	113.9	L1246	L1246-P1257 HydrophobicContact CD2-CB 3.81Å
1258	R	76.9	Confident	78.4	Confident	160 Å²	160	82.1 Å²	82.1	60%	0.604	42%	0.419	S	S	*	.	S	Bend	trans	-137.5	139.5	-174.2	-58.4	-178.9	173.3	-165.6	-5.7	111.7	L1256 L1260 D1261 L1262	L1256-R1258 VanDerWaalsContact C-N 3.25Å; L1256-R1258 PolarHBondContact O-N 3.34Å; R1258-L1260 PolarHBondContact O-N 3.15Å; R1258-D1261 WeakPolarHBondContact CB-OD2 3.33Å; R1258-D1261 PolarHBondContact O-N 3.41Å; R1258-D1261 VanDerWaalsContact O-N 3.1Å; R1258-L1262 PolarHBondContact O-N 2.95Å; R1258-L1262 VanDerWaalsContact O-N 3.09Å
1259	E	78.3	Confident	78.7	Confident	120 Å²	120	79.5 Å²	79.5	56%	0.561	41%	0.407	S	S	*	.	H	α-helix	trans	-59.8	-33.8	-178.5	-166.5	-176	172.5	0	0	112.5	L1247 L1262 Q1263	L1247-E1259 HydrophobicContact CD1-CB 3.76Å; L1247-E1259 HydrophobicContact CD1-CG 4.25Å; E1259-L1262 PolarHBondContact O-N 2.85Å; E1259-Q1263 VanDerWaalsContact O-CB 3.3Å; E1259-Q1263 WeakPolarHBondContact O-CB 3.48Å; E1259-Q1263 PolarHBondContact O-N 2.81Å
1260	L	78.6	Confident	78.2	Confident	120 Å²	120	83.2 Å²	83.2	63%	0.628	44%	0.437	S	S	*	.	H	α-helix	trans	-66.9	-38.6	176.8	-175.1	63.4	0	0	0	112.5	R1258 Q1263 M1264	R1258-L1260 PolarHBondContact O-N 3.15Å; L1260-Q1263 PolarHBondContact O-N 2.84Å; L1260-M1264 WeakPolarHBondContact O-CB 2.99Å; L1260-M1264 PolarHBondContact O-N 2.8Å
1261	D	80.4	Confident	77.7	Confident	75 Å²	75	82.3 Å²	82.3	40%	0.401	43%	0.431	S	S	.	.	H	α-helix	trans	-70.6	-40	177.4	-61.3	-37.6	0	0	0	110.1	R1258 M1264 H1265	R1258-D1261 WeakPolarHBondContact CB-OD2 3.33Å; R1258-D1261 PolarHBondContact O-N 3.41Å; R1258-D1261 VanDerWaalsContact O-N 3.1Å; D1261-M1264 WeakPolarHBondContact O-CB 3.36Å; D1261-M1264 PolarHBondContact O-N 3.35Å; D1261-H1265 WeakPolarHBondContact O-CB 3.38Å; D1261-H1265 PolarHBondContact O-N 2.82Å
1262	L	84.9	Confident	76.6	Confident	18 Å²	18	80 Å²	80	9%	0.094	44%	0.435	C	S	.	.	H	α-helix	trans	-61.5	-42.3	171.8	176.9	58.4	0	0	0	112.4	L1247 C1249 L1256 R1258 E1259 H1265 Y1266	L1247-L1262 HydrophobicContact CB-CD2 3.65Å; C1249-L1262 HydrophobicContact CB-CD1 3.55Å; L1256-L1262 HydrophobicContact CB-CB 4.37Å; L1256-L1262 HydrophobicContact CD1-CB 4.18Å; L1256-L1262 HydrophobicContact CD1-CD1 4.17Å; R1258-L1262 PolarHBondContact O-N 2.95Å; R1258-L1262 VanDerWaalsContact O-N 3.09Å; E1259-L1262 PolarHBondContact O-N 2.85Å; L1262-H1265 PolarHBondContact O-N 3.26Å; L1262-Y1266 HydrophobicContact CD1-CD2 3.89Å; L1262-Y1266 HydrophobicContact CD1-CE2 3.45Å; L1262-Y1266 VanDerWaalsContact CD1-CE2 3.45Å; L1262-Y1266 HydrophobicContact CD2-CE2 4.01Å; L1262-Y1266 HydrophobicContact CG-CD2 3.91Å; L1262-Y1266 HydrophobicContact CG-CE2 3.53Å; L1262-Y1266 VanDerWaalsContact O-CD2 3.25Å; L1262-Y1266 WeakPolarHBondContact O-CD2 3.33Å; L1262-Y1266 PolarHBondContact O-N 3.35Å
1263	Q	79.6	Confident	74.4	Confident	83 Å²	83	86.4 Å²	86.4	39%	0.388	46%	0.46	S	S	.	.	H	α-helix	trans	-68.2	-36.6	177	-170.1	167.8	88.3	0	0	112.1	E1259 L1260 H1265 L1267	E1259-Q1263 VanDerWaalsContact O-CB 3.3Å; E1259-Q1263 WeakPolarHBondContact O-CB 3.48Å; E1259-Q1263 PolarHBondContact O-N 2.81Å; L1260-Q1263 PolarHBondContact O-N 2.84Å; Q1263-H1265 VanDerWaalsContact C-N 3.34Å; Q1263-L1267 WeakPolarHBondContact O-CG 3.25Å; Q1263-L1267 PolarHBondContact O-N 3.35Å; Q1263-L1267 VanDerWaalsContact O-N 3.15Å
1264	M	82.5	Confident	72.8	Confident	98 Å²	98	95.7 Å²	95.7	48%	0.483	50%	0.499	S	S	.	.	H	α-helix	trans	-63.3	-37.6	168.2	-91.2	-60.1	-48.9	0	0	112.4	L1260 D1261 L1267 Q1268	L1260-M1264 WeakPolarHBondContact O-CB 2.99Å; L1260-M1264 PolarHBondContact O-N 2.8Å; D1261-M1264 WeakPolarHBondContact O-CB 3.36Å; D1261-M1264 PolarHBondContact O-N 3.35Å; M1264-L1267 WeakPolarHBondContact O-CB 3.41Å; M1264-L1267 PolarHBondContact O-N 2.87Å; M1264-Q1268 WeakPolarHBondContact O-CG 3.45Å; M1264-Q1268 PolarHBondContact O-N 3.37Å; M1264-Q1268 VanDerWaalsContact O-N 3.12Å
1265	H	84.6	Confident	72.5	Confident	29 Å²	29	95.8 Å²	95.8	13%	0.134	50%	0.499	C	S	.	.	H	α-helix	trans	-73.8	-39.9	-179.5	-165.5	52.7	0	0	0	112.5	C1252 L1254 L1256 D1261 L1262 Q1263 L1267 Q1268 H1269	C1252-H1265 PolarHBondContact SG-NE2 3.16Å; L1254-H1265 WeakPolarHBondContact CD1-NE2 3.17Å; L1256-H1265 HydrophobicContact CD1-CB 3.73Å; D1261-H1265 WeakPolarHBondContact O-CB 3.38Å; D1261-H1265 PolarHBondContact O-N 2.82Å; L1262-H1265 PolarHBondContact O-N 3.26Å; Q1263-H1265 VanDerWaalsContact C-N 3.34Å; H1265-L1267 PolarHBondContact O-N 2.9Å; H1265-Q1268 PolarHBondContact ND1-OE1 2.87Å; H1265-Q1268 WeakPolarHBondContact O-CA 3.12Å; H1265-Q1268 WeakPolarHBondContact O-CB 3.07Å; H1265-Q1268 PolarHBondContact O-N 2.86Å; H1265-H1269 AromaticContact CD2-CD2 3.97Å; H1265-H1269 AromaticContact CD2-NE2 2.72Å; H1265-H1269 PolarHBondContact CD2-NE2 2.85Å; H1265-H1269 AromaticContact CE1-NE2 2.91Å; H1265-H1269 PolarHBondContact CE1-NE2 3.48Å; H1265-H1269 AromaticContact CG-NE2 3.6Å; H1265-H1269 AromaticContact ND1-NE2 3.69Å; H1265-H1269 AromaticContact NE2-CD2 3.89Å; H1265-H1269 AromaticContact NE2-NE2 2.14Å; H1265-H1269 PolarHBondContact NE2-NE2 3.49Å; H1265-H1269 PolarHBondContact O-CD2 3.38Å; H1265-H1269 VanDerWaalsContact O-CD2 3.24Å; H1265-H1269 PolarHBondContact O-N 3.29Å; H1265-H1269 VanDerWaalsContact O-N 3.09Å
1266	Y	84.8	Confident	72.4	Confident	76 Å²	76	97.6 Å²	97.6	30%	0.298	50%	0.502	S	S	.	.	H	α-helix	trans	-59	-36.7	168.1	-74.9	-56.1	0	0	0	112.1	C1249 M1250 I1251 L1262 Q1268 H1269 A1270	C1249-Y1266 HydrophobicContact CB-CE1 4.45Å; C1249-Y1266 WeakPolarHBondContact SG-CE1 3.3Å; M1250-Y1266 HydrophobicContact CB-CE1 4.48Å; M1250-Y1266 WeakPolarHBondContact CG-OH 3.44Å; M1250-Y1266 PolarHBondContact N-OH 3.43Å; I1251-Y1266 HydrophobicContact CD1-CD1 3.86Å; I1251-Y1266 HydrophobicContact CD1-CE1 4.2Å; I1251-Y1266 HydrophobicContact CG1-CD1 4.22Å; I1251-Y1266 HydrophobicContact CG1-CE1 4.06Å; L1262-Y1266 HydrophobicContact CD1-CD2 3.89Å; L1262-Y1266 HydrophobicContact CD1-CE2 3.45Å; L1262-Y1266 VanDerWaalsContact CD1-CE2 3.45Å; L1262-Y1266 HydrophobicContact CD2-CE2 4.01Å; L1262-Y1266 HydrophobicContact CG-CD2 3.91Å; L1262-Y1266 HydrophobicContact CG-CE2 3.53Å; L1262-Y1266 VanDerWaalsContact O-CD2 3.25Å; L1262-Y1266 WeakPolarHBondContact O-CD2 3.33Å; L1262-Y1266 PolarHBondContact O-N 3.35Å; Y1266-Q1268 VanDerWaalsContact C-N 3.26Å; Y1266-Q1268 PolarHBondContact O-N 3.43Å; Y1266-H1269 PolarHBondContact O-N 3.36Å; Y1266-A1270 WeakPolarHBondContact O-CB 3.42Å; Y1266-A1270 PolarHBondContact O-N 2.87Å
1267	L	82.2	Confident	71.9	Confident	90 Å²	90	100.8 Å²	100.8	47%	0.471	52%	0.519	S	S	.	.	H	α-helix	trans	-66.8	-23.4	172.7	-81.6	165.2	0	0	0	113.4	Q1263 M1264 H1265 Q1271	Q1263-L1267 WeakPolarHBondContact O-CG 3.25Å; Q1263-L1267 PolarHBondContact O-N 3.35Å; Q1263-L1267 VanDerWaalsContact O-N 3.15Å; M1264-L1267 WeakPolarHBondContact O-CB 3.41Å; M1264-L1267 PolarHBondContact O-N 2.87Å; H1265-L1267 PolarHBondContact O-N 2.9Å; L1267-Q1271 WeakPolarHBondContact O-CG 3.41Å; L1267-Q1271 PolarHBondContact O-NE2 3.27Å
1268	Q	77.3	Confident	72.4	Confident	107 Å²	107	103.4 Å²	103.4	50%	0.5	53%	0.527	S	S	.	.	H	α-helix	trans	-76.8	-41.8	172	-70	169.7	-30	0	0	111.5	M1264 H1265 Y1266 A1270 Q1271 G1272	M1264-Q1268 WeakPolarHBondContact O-CG 3.45Å; M1264-Q1268 PolarHBondContact O-N 3.37Å; M1264-Q1268 VanDerWaalsContact O-N 3.12Å; H1265-Q1268 PolarHBondContact ND1-OE1 2.87Å; H1265-Q1268 WeakPolarHBondContact O-CA 3.12Å; H1265-Q1268 WeakPolarHBondContact O-CB 3.07Å; H1265-Q1268 PolarHBondContact O-N 2.86Å; Y1266-Q1268 VanDerWaalsContact C-N 3.26Å; Y1266-Q1268 PolarHBondContact O-N 3.43Å; Q1268-A1270 VanDerWaalsContact C-N 3.34Å; Q1268-A1270 PolarHBondContact O-N 3.12Å; Q1268-Q1271 CarbonylContact O-C 3.48Å; Q1268-Q1271 WeakPolarHBondContact O-CA 3.15Å; Q1268-Q1271 WeakPolarHBondContact O-CB 3.28Å; Q1268-Q1271 PolarHBondContact O-N 3.48Å; Q1268-G1272 PolarHBondContact O-N 3.32Å
1269	H	79.6	Confident	72.1	Confident	67 Å²	67	99.8 Å²	99.8	31%	0.31	52%	0.523	S	S	.	.	H	α-helix	trans	-59.3	-44.5	172.2	-71.7	-64.9	0	0	0	111.7	I1251 C1252 H1265 Y1266 Q1271 G1272	I1251-H1269 HydrophobicContact CD1-CB 3.93Å; I1251-H1269 HydrophobicContact CG2-CB 4.19Å; C1252-H1269 WeakPolarHBondContact CB-CE1 3.14Å; C1252-H1269 VanDerWaalsContact CB-NE2 3.32Å; C1252-H1269 WeakPolarHBondContact CB-NE2 3.17Å; C1252-H1269 PolarHBondContact SG-NE2 3.4Å; H1265-H1269 AromaticContact CD2-CD2 3.97Å; H1265-H1269 AromaticContact CD2-NE2 2.72Å; H1265-H1269 PolarHBondContact CD2-NE2 2.85Å; H1265-H1269 AromaticContact CE1-NE2 2.91Å; H1265-H1269 PolarHBondContact CE1-NE2 3.48Å; H1265-H1269 AromaticContact CG-NE2 3.6Å; H1265-H1269 AromaticContact ND1-NE2 3.69Å; H1265-H1269 AromaticContact NE2-CD2 3.89Å; H1265-H1269 AromaticContact NE2-NE2 2.14Å; H1265-H1269 PolarHBondContact NE2-NE2 3.49Å; H1265-H1269 PolarHBondContact O-CD2 3.38Å; H1265-H1269 VanDerWaalsContact O-CD2 3.24Å; H1265-H1269 PolarHBondContact O-N 3.29Å; H1265-H1269 VanDerWaalsContact O-N 3.09Å; Y1266-H1269 PolarHBondContact O-N 3.36Å; H1269-Q1271 PolarHBondContact O-N 2.89Å; H1269-G1272 PolarHBondContact O-N 2.93Å
1270	A	69.4	Low	71.7	Confident	80 Å²	80	98.5 Å²	98.5	66%	0.661	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	1.1	173.6	0	0	0	0	0	115	Y1266 Q1268	Y1266-A1270 WeakPolarHBondContact O-CB 3.42Å; Y1266-A1270 PolarHBondContact O-N 2.87Å; Q1268-A1270 VanDerWaalsContact C-N 3.34Å; Q1268-A1270 PolarHBondContact O-N 3.12Å
1271	Q	66	Low	71.2	Confident	152 Å²	152	96.9 Å²	96.9	71%	0.71	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	-3.6	170.3	-73.8	171.9	78.1	0	0	112.8	L1267 Q1268 H1269	L1267-Q1271 WeakPolarHBondContact O-CG 3.41Å; L1267-Q1271 PolarHBondContact O-NE2 3.27Å; Q1268-Q1271 CarbonylContact O-C 3.48Å; Q1268-Q1271 WeakPolarHBondContact O-CA 3.15Å; Q1268-Q1271 WeakPolarHBondContact O-CB 3.28Å; Q1268-Q1271 PolarHBondContact O-N 3.48Å; H1269-Q1271 PolarHBondContact O-N 2.89Å
1272	G	48.7	Very low	70.5	Confident	64 Å²	64	98.6 Å²	98.6	66%	0.66	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-17.7	-176.7	0	0	0	0	0	115.4	Q1268 H1269	Q1268-G1272 PolarHBondContact O-N 3.32Å; H1269-G1272 PolarHBondContact O-N 2.93Å
1273	E	38.2	Very low	69.3	Low	183 Å²	183	105.3 Å²	105.3	86%	0.855	56%	0.556	S	S	*	*			trans	-114.8	83.7	-178.9	-65.6	-170.5	158.5	0	0	112.2
1274	I	38.6	Very low	68.3	Low	235 Å²	235	107.4 Å²	107.4	100%	1.205	57%	0.572	S	S	*	*			trans	-144.1	0	159.5	-55.1	-177.3	0	0	0	108.9

Retrieved 1,274 of 1,274 residues in 1064.2 ms (Link to these results)

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